Population Ageing and the Theory of Demographic Transition: The ...
African Journals Online (AJOL)
Population Ageing and the Theory of Demographic Transition: The Case of Mauritius. ... the life expectancy of the population and consequently, the society is ageing. ... Originality/Value – Although some studies have been done on ageing yet ...
The demographic transition: an attempt to reformulate a population theory.
Hofsten, E
1981-01-01
In this effort to reformulate the demographic transition theory, attention is directed to the following: Malthus and Karl Marx's criticism of his principle of population; the 1st stage of transition, i.e., high mortality, high fertility, and slow population growth; the 2nd stage of declining mortality; the 3rd stage of declining fertility; the 4th stage when mortality and fertility are both low; the growth potential; and the demographic transition in the 3rd world countries. The demographic transition theory has become popular among demographers, economists, historians, and others interested in studying the development of population over time since the end of World War 2. This interest has most likely been created by the anxiety over the population explosion in the 3rd world countries. Transition has made demographers believe that the period of rapid population growth will be automatically succeeded by a period of more or less constant population size. The question that arises is whether it is as simple as that. Demographic transition has to a great extent taken the place of Malthus' principle of population as a general theory of population. Demographic transition appears to describe in a satisfactory way the development of population which all currently industrialized countires have passed through, when going from the preindustrial to the present industrialized stage. The objectives to demographic transition as a general theory are considered. Some of the factors which have accounted for the decline in fertility in Europe may also apply to the 3rd world countries. 1 such factor is the effect of reduced infant and child mortality on the individual level. The fertility decline, caused by reduced infant and child mortality may, however, be of limited size. The great amount of unemployment in the 3rd world may affect fertility in a downward direction. The fertility decline in Europe occurred simultaneously with an industrialization process, which gradually covered the
THE SECOND DEMOGRAPHIC TRANSITION THEORY: A Review and Appraisal.
Zaidi, Batool; Morgan, S Philip
2017-07-01
References to the second demographic transition (SDT) concept/theoretical framework have increased dramatically in the last two decades. The SDT predicts unilinear change toward very low fertility and a diversity of union and family types. The primary driver of these changes is a powerful, inevitable and irreversible shift in attitudes and norms in the direction of greater individual freedom and self-actualization. First, we describe the origin of this framework and its evolution over time. Second, we review the empirical fit of the framework to major changes in demographic and family behavior in the U.S., the West, and beyond. As has been the case for other unilinear, developmental theories of demographic/family change, the SDT failed to predict many contemporary patterns of change/difference. Finally, we review previous critiques and identify fundamental weaknesses of this perspective, and provide brief comparisons to selected alternative approaches.
Bourcier De Carbon, P
1998-01-01
The work of Adolphe Landry is reviewed in relation to development of demographic transition theory. Landry was appointed administrator in 1912 of the National Alliance Against Depopulation and remained active in it his whole life. He also helped create family allowance programs in France. As early as 1909, Landry described three different population regimes. In the "primitive" regime, which characterized all nonhuman life and human life during most of history, the population was adjusted to available subsistence by mortality. In the "intermediate" phase, restrictions on marriage and control of reproduction outside marriage maintained the population at a level below the maximum supportable. In the "contemporary" regime, the universal practice of contraception and abortion could lead to very low levels of fertility. The spread of contraception and low fertility appeared to Landry a true demographic revolution. He attributed the acceptance of contraception to a change in the common aspirations of human beings regarding their conditions, a desire for improved material well-being and social advancement, and an increased spirit of rationality and even calculation in their behavior. Landry believed that the contemporary regime, unlike the preceding two, had no mechanism implying equilibrium. The demographic revolution freed fertility from social determinants and linked it more closely to individual interests. Landry expected the contemporary regime to spread throughout the entire world, with many areas still in the primitive phase passing directly to the contemporary. He was concerned with the effects of demographic aging, and he deplored birth control propaganda that claimed it as a cure for unemployment and for overpopulation in the poor Asian countries. The birth control movements in England and the US were successful in bringing the two countries into the contemporary regime. A number of organizations such as the Population Association of America and the Office of
[The theory of the demographic transition as a reference for demo-economic models].
Genne, M
1981-01-01
The aim of the theory of demographic transition (TTD) is to better understand the behavior and interrelationship of economic and demographic variables. There are 2 types of demo-economic models: 1) the malthusian models, which consider demographic variables as pure exogenous variables, and 2) the neoclassical models, which consider demographic variables as strictly endogenous. If TTD can explore the behavior of exogenous and endogenous demographic variables, it cannot demonstrate neither the relation nor the order of causality among the various demographic and economic variables, but it is simply the theoretical framework of a complex social and economic phenomenon which started in Europe in the 19th Century, and which today can be extended to developing countries. There are 4 stages in the TTD; the 1st stage is characterized by high levels of fecundity and mortality; the 2nd stage is characterized by high fecundity levels and declining mortality levels; the 3rd stage is characterized by declining fecundity levels and low mortality levels; the 4th stage is characterized by low fertility and mortality levels. The impact of economic variables over mortality and birth rates is evident for mortality rates, which decline earlier and at a greater speed than birth rates. According to reliable mathematical predictions, around the year 1987 mortality rates in developing countries will have reached the low level of European countries, and growth rate will be only 1.5%. If the validity of demo-economic models has not yet been established, TTD has clearly shown that social and economic development is the factor which influences demographic expansion.
Learning-by-doing, population pressure, and the theory of demographic transition.
Strulik, H
1997-01-01
The long-term effects of two interdependent relations between economic growth and population growth are discussed. The empirical work of Boserup (1981) was utilized, which focused on rural, sparsely populated economies with low income per capita. According to the formulation of the population-push hypothesis, learning-by-doing effects in production lead to increasing returns to scale and, therefore, to a positive correlation between economic and population growth. In accordance with the theory of demographic transition, the population growth rate initially increases with rising income levels and then declines. The approach originating from Cigno (1984) modified the economic model, which allowed the establishment of two different stable equilibria. Regarding this relationship, the existence and stability of low-income and high-income equilibrium was shown in a neoclassical growth model. Under plausible conditions a demo-economic transition from the first to the second steady-state took place. The instability of the Malthusian steady-state is also possible when a country develops along a path of economic growth which is compatible with the demographic transition. In this context, learning means the application of new techniques of agrarian production. In developed economies with a stable population the learning-or-doing decision lead to accumulation of human capital and the invention of new technologies and goods. The interdependence of income-determined population growth and learning-by-doing may serve as an explanation for the weak and partly controversial empirical support for an overall correlation between income and population growth. The result yielded a meaningful interpretation of the population-push hypothesis, which is consistent with the empirical findings on the correlation between economic and population growth.
Understanding the Demographic and Health Transition in ...
International Development Research Centre (IDRC) Digital Library (Canada)
23 juin 2009 ... Understanding the Demographic and Health Transition in Developing Countries ... countries comes from analysis of demographic and health survey data. ... Navrongo (Ghana), Matlab (Bangladesh) and Filabavi (Viet Nam) ...
Demographic transitions in Europe and the world
Willekens, Frans
The demographic transition is a universal phenomenon. All regions of the world experience a change from high levels of mortality and fertility to low levels. The onset and pace of the demographic transition vary between regions and countries because of differences in timing of events and conditions
Understanding the Demographic and Health Transition in ...
International Development Research Centre (IDRC) Digital Library (Canada)
The shift from high to low levels of mortality and fertility called the demographic transition occurred over a century ago in the developed world. While the reasons for the transition in Western Europe and North America are well documented, little is known about the transition in developing countries except that it is reported to ...
Demographic transitions in Europe and the world
Willekens, F.J.; Matthijs, K.; Neels, K.; Timmerman, C.; Haers, J.; Mels, S.
2016-01-01
Willekens, F. (2015) Demographic transitions in Europe and the world. In: K. Matthijs, K. Neels, C. Timmerman. J. Haers and S. Mels eds. Population change at work in Europe, the Middle-East and North Africa. Beyond the demographic divide. Ashgate (International Population Studies Series) pp. 13-44.
The second demographic transition: a concise overview of its development.
Lesthaeghe, Ron
2014-12-23
This article gives a concise overview of the theoretical development of the concept of the "second demographic transition" since it was coined in 1986, its components, and its applicability, first to European populations and subsequently also to non-European societies as well. Both the demographic and the societal contrasts between the first demographic transition (FDT) and the second demographic transition (SDT) are highlighted. Then, the major criticisms of the SDT theory are outlined, and these issues are discussed in the light of the most recent developments in Europe, the United States, the Far East, and Latin America. It turns out that three major SDT patterns have developed and that these evolutions are contingent on much older systems of kinship and family organization.
Life Expectancy and Economic Growth : The Role of the Demographic Transition
Cervellati, Matteo; Sunde, Uwe
2011-01-01
In this paper we investigate the causal effect of life expectancy on economic growth by explicitly accounting for the role of the demographic transition. In addition to focusing on issues of empirical identification, this paper emphasizes the role of the econometric specification. We present a simple theory of the economic and demographic transition where individuals' education and fertility decisions depend on their life expectancy. The theory predicts that before the demographic transition ...
Variational Transition State Theory
Energy Technology Data Exchange (ETDEWEB)
Truhlar, Donald G. [Univ. of Minnesota, Minneapolis, MN (United States)
2016-09-29
This is the final report on a project involving the development and applications of variational transition state theory. This project involved the development of variational transition state theory for gas-phase reactions, including optimized multidimensional tunneling contributions and the application of this theory to gas-phase reactions with a special emphasis on developing reaction rate theory in directions that are important for applications to combustion. The development of variational transition state theory with optimized multidimensional tunneling as a useful computational tool for combustion kinetics involved eight objectives.
J. de Haan (Hans)
2010-01-01
textabstractThis thesis is a treatise on a theory for societal transitions: pillar theory. Societal transitions are complex processes taking place in complex systems, large-scale, long-term processes in which societal systems radically change the way they are composed and function. Since we all are
Which transition comes first? Urban and demographic transitions in Belgium and Sweden
Directory of Open Access Journals (Sweden)
Philippe Bocquier
2015-12-01
Full Text Available Background: Several theories compete to explain the main drivers of urbanisation, past and present, in relation to both demographic transition and economic development. One hypothesis is that rural-to-urban migration is the driver of urbanisation; another is that urban mortality decline actually triggered urban transition. Objective: This paper reconsiders the relationship between demographic (vital migration and urban transitions by analysing the long-term contribution of natural and migratory movements to urban transition. The respective contributions of birth, death, and migration and their timing will indicate whether economic development, through labour force migration, or vital transition mainly determines urban transition. Methods: After examining the spatial dimension of the demographic transition theory, we use 19th and 20th century series on Sweden and Belgium to better identify the migration component of urban transition through the computation of growth difference between urban and rural areas, accounting for the often neglected reclassification effect. Results: In both Sweden and Belgium, migration is the direct or indirect (through reclassification engine of urban transition and its contribution precedes the onset of vital transition, while the vital transition has a secondary, unstable, and negative role in the urban transition. Conclusions: Changes in the economic sphere are reinstated as the underlying cause of population change, acting through the shift of human capital in space. Methodological consequences are then drawn for analysing vital and urban transitions in an increasingly interdependent world. Contribution: The paper contributes to the theoretical literature on urban and demographic transitions in relation to economic development. The proposed method evaluates migration contribution without having to measure it.
Demographic Structural Theory: 25 Years On
Directory of Open Access Journals (Sweden)
Jack A. Goldstone
2017-12-01
Full Text Available I am grateful to Cliodynamics for this special issue revisiting the ideas put forth in Revolution and Rebellion in the Early Modern World (Goldstone 1991, 2016 a quarter century ago. The two things that one could hope for in advancing any theory are that it proves capable of being advanced and enriched by other scholars, and that it proves capable of being applied in new ways and to new phenomena that were not anticipated. This issue gives examples of both, and shows how scholars are even now only beginning to tap the possibilities of Demographic Structural Theory (DST in explaining politics, history, and long-term economic trends. In this essay, I will tell the story of how demographic structural theory was conceived, relate its early reception among scholars, and comment on the important contributions by other scholars to this special issue.
Variational transition state theory
International Nuclear Information System (INIS)
Truhlar, D.G.
1986-01-01
This project is concerned with the development and applications of generalized transition state theory and multidimensional tunneling approximations to chemical reaction rates. They have developed and implemented several practical versions of variational transition state theory (VTST), namely canonical variational theory (CVT), improved canonical variational theory (ICVT), and microcanonical variational theory (μVT). They have also developed and implemented several accurate multidimensional semiclassical tunneling approximations, the most accurate of which are the small-curvature semiclassical adiabatic (SCSA), large-curvature version-3 (LC3), and least-action (LA) approximations. They have applied the methods to thermal rate constants, using transmission coefficients based on ground-state tunneling, and they have also presented and applied adiabatic and diabatic extensions to calculated rate constants for vibrationally excited reactants. Their general goal is to develop accurate methods for calculating chemical reaction rate constants that remain practical even for reasonably complicated molecules. The approximations mentioned above yield rate constants for systems whose potential energy surface is known or assumed. Thus a second, equally important aspect of their work is the determination or modeling, semi-empirically and/or from electronic structure calculations, of potential energy surfaces
[Considerations concerning the theory of the demographic revolution. Its development in Cuba].
Hernandez Castellon, R
1983-01-01
A review of the world's literature on the demographic transition is presented. The author, in his analysis of the non-Marxist literature, suggests that considerable efforts have been made to update demographic transition theory in order to take into account recent demographic trends in developing countries. On the other hand, the Marxist literature is divided into studies in which attempts are made to develop general demographic theories and those in which the value of such theories is questioned. The paper concludes with a description of the demographic transition process as it has been experienced in Cuba, and it is noted that a major feature of this process has been a general trend toward a reduction in demographic differentials.
Transition Theory – Sustainable Transition of Socio-Technical Systems
DEFF Research Database (Denmark)
Søndergård, Bent; Holm, Jesper; Stauning, Inger
2015-01-01
Theories of transition management, transition studies and social practise theory Applied to studies of hosuing and construction......Theories of transition management, transition studies and social practise theory Applied to studies of hosuing and construction...
Variational transition-state theory
International Nuclear Information System (INIS)
Truhlar, D.G.; Garrett, B.C.
1980-01-01
A general introduction to and some results from studies of a procedure called variational transition-state theory are presented. A fundamental assumption of this theory is that the net rate of forward reaction at equilibrium equals the equilibrium flux in the product direction through the transition state where the transition state is a surface in phase space dividing reactants from products. Classical generalized-transition-state-theory calculations for nine collinear systems are compared to classical trajectory calculations. This new technique should provide useful insight into the successes and failures of the conventional theory and useful quantitative estimates of possible errors on the predictions of conventional transition-state theory. This should also contribute to a more accurate theory now available for the practical calculations of chemical reaction rates and thermochemical and structural interpretations of rate processes
Policy Implications of the Next World Demographic Transition
Harbison, Sarah F.; Robinson, Warren C.
2002-01-01
Although the world demographic transition from high to low fertility appears to be nearing its completion, observed in perspective, this is the latest in a series of such transitions stretching back into prehistory. A stable new equilibrium is far from inevitable; indeed, it is unlikely. Many countries are experiencing below‐replacement‐level fertility, and this trend is spreading. Couples are now able to choose their family size, free of the traditional pressures to bear children that was ch...
Russian Federation : From the first to second demographic transition
Zakharov, Sergei
2008-01-01
The demographic transition in Russia was accelerated by several social cataclysms during the "Soviet type" modernization. Frequent changes in the timing of births and marriages engendered a mass "abortion culture". Contraceptive devices of poor quality were produced on a limited scale. The Soviet
Mortality-fertility synergies during the demographic transition in the developed world.
Sánchez-Barricarte, Jesús J
2017-07-01
The classic theory used to explain the demographic transition assumes that mortality is the key explanatory variable influencing the decline in fertility. However, the empirical results obtained in what is known as the Princeton European Fertility Project have led many specialists to question this assumption. Using both national and provincial aggregated data for 25 countries over a long time span, the analysis reported in this paper found that mortality does indeed play a fundamental role in accounting for the main demographic changes that occurred both before and during the transitional period. Others' research based on individual data has shown clearly that the number of surviving children was indeed an important factor for reproductive decisions. My analysis, using aggregated data, reached largely similar conclusions regarding the role of mortality in changing reproductive trends, via its impact on nuptiality and marital fertility at different stages of the demographic transition.
The Second Demographic Transition in Israel: One for All?
Directory of Open Access Journals (Sweden)
Evgenia Bystrov
2012-08-01
Full Text Available This article explores family behaviours and attitudes in Israel over the last decades through the lens of the Second Demographic Transition (SDT. Israel is divided by religious affiliation, the level of religiosity, ethnic origin and timing of immigration. Although fertility transition to replacement level among certain societal groups has been previously shown, the question of how the transition unfolds in other domains remains open. The goal of this paper is to highlight the diversity of marital and fertility transitions and non-transitions among various groups of this heterogeneous society, and to compare Israel's transitions to European ones. The data sources which are used are cross-national large scale surveys, national representative surveys, and Population Register data. The data were disaggregated by religion, religiousness and ethnic origin. Emancipative value change, postponement of marriage, alternative living arrangements and a growing variety of fertility regimes were analyzed. A full range of pre-transitional, transitional, and post-transitional elements was found among the groups. Such sign of the SDT as growing childlessness was not found, and the spread of other features as unmarried cohabitation and non-marital childbearing was found limited. Population composition effects were isolated. It was found that the level of religiosity and the country of origin are important factors which differentiate family behaviours and attitudes. The connection between value orientation of the groups within Israel and their family behaviours is discussed. The socio-structural and institutional constraints that might impede further progression of the Second Demographic Transition in Israel are also discussed. Further research directions are suggested.
Demographic model of the Neolithic transition in Central Europe
Directory of Open Access Journals (Sweden)
Patrik Galeta
2009-12-01
Full Text Available Several recent lines of evidence indicate more intensive contact between LBK farmers and indigenous foragers in Central Europe (5600–5400 calBC. Strong continuity has been identified between Mesolithic and Neolithic material cultures; faunal assemblages, and isotopic analyses of diet have revealed a greater role of hunting in LBK communities; genetic analyses have suggested that the modern Central European gene pool is mainly of Palaeolithic origin. Surprisingly little attention has been paid to demographic aspects of the Neolithic transition. In our study, demographic simulations were performed to assess the demographic conditions that would allow LBK farmers to spread across central Europe without any admixture with Mesolithic foragers. We constructed a stochastic demographic model of changes in farming population size. Model parameters were constrained by data from human demography, archaeology, and human ecology. Our results indicate that the establishment of farming communities in Central Europe without an admixture with foragers was highly improbable. The demographic conditions necessary for colonization were beyond the potential of the Neolithic population. Our study supports the integrationists’ view of the Neolithic transition in Central Europe.
Gauge theory of glass transition
International Nuclear Information System (INIS)
Vasin, Mikhail
2011-01-01
A new analytical approach for the description of the glass transition in a frustrated system is suggested. The theory is based on the non-equilibrium dynamics technique, and takes into account the interaction of the local order field with the massive gauge field, which describes frustration-induced plastic deformation. The glass transition is regarded as a phase transition interrupted because of the premature critical slowing-down of one of the degrees of freedom caused by the frustrations. It is shown that freezing of the system appears when the correlation length and relaxation time of the gauge field diverge. The Vogel–Fulcher–Tammann relation for the transition kinetics and the critical exponent for the nonlinear susceptibility, 2.5∼ t correlation function dependence on time, and explains the boson peak appearance on this curve. In addition, the function of the glass transition temperature value with cooling rate is derived; this dependence fully conforms with known experimental data
Turkey’s Epidemiological and Demographic Transitions: 1931-2013
Directory of Open Access Journals (Sweden)
Coşkun Bakar
2017-08-01
Full Text Available Background: The causes of death have changed with regard to the epidemiological and demographic events in society. There is no evidence of prior research into the epidemiological transition in Turkey. This transition in Turkey should be observed starting with the Ottoman Empire period (19th to early 20th century. However, information about the Ottoman Empire is quite limited. Aims: To discuss the epidemiological and demographic transitions in Turkey, using demographic, educational and urbanization data in our present study. Study Design: A descriptive archive study. Methods: Mortality statistics dating from 1931 and published by the Turkish Statistical Institute were analysed, and the causes of death were coded and classified according to ICD-10. Other data were obtained from the published reports and studies regarding the issue. Results: In the 1930s, Turkey’s life expectancy was low (aged 40 years, fertility and mortality rates were high (respectively 45% and 31%, and the main causes of death were infectious diseases. Nowadays, life expectancy is close to 80 years, the total fertility rate has dropped to 2.1 per woman, and the main causes of death are chronic diseases and cancer. The population rate in the urban areas has increased steadily from 24.2% in 1927 to 77.3% in 2012. level of education has also increased during this period. In 1935, less than 10% of women were literate, and in 2013 90% were literate. Qualitative and quantitative increase have been observed in the presentation and access of healthcare services compared to the early years of the Republic. Conclusion: Turkey has been undergoing a modernization period in the last 200 years, and it is believed that the epidemiological and demographic transitions result from this period. This process has led to urbanization and an increase in the level of education, as well as a decrease in premature deaths, lower fertility rates, and an increase in the elderly population and chronic
Modern theories of phase transitions
International Nuclear Information System (INIS)
Rajaraman, R.
1979-01-01
Modern applications of the ideas of phase transitions to nuclear systems and the modern techniques as applied to familiar phase transitions in solid-state physics are discussed with illustrations. The phenomenon of pion condensation in nuclei and neutron stars, is presented as an example of phase transitions in nuclear systems. The central physical ideas behind this subject as well as techniques used to tackle it are broadly summarised. It is pointed out that unlike familiar examples of ferromagnetism or superconductivity, the order parameter here has spatial variation even in the ground state. Possible experimental consequences are discussed. As an example of the second category, the use of renormalisation group techniques in solid state physics is reviewed. The basic idea behind the renormalisation group in the infra-red (thermodynamic) limit is presented. The observed universality and scaling of critical exponents in second order phase transitions is explained in a model-independent way. (auth.)
Topological transitions in the theory of spacetime
International Nuclear Information System (INIS)
Konstantinov, M.Y.; Melnikov, V.N.
1986-01-01
Results of a realisation of the topological transitions hypothesis are presented. The basic difficulties in the construction of quantum topological transition theory are connected with a necessity to introduce a new non-local interaction defined on a space of topological states. So the general method of construction and study of topological transitions classical models is formulated as a necessary step towards a corresponding quantum description. Their local properties, including an asymptotic behaviour in the neighbourhood of the transition, are studied and applications to problems of gravitation and cosmology are given. The method used is shown to lead to a scalar-tensor theory of topological transitions. Different variants of this theory and its main features are discussed. (author)
Phase transitions in field theory
International Nuclear Information System (INIS)
Carvalho, C.A.A. de; Bollini, C.G.; Giambiagi, J.J.
1984-01-01
By means of an example for which the effective potential is explicitly calculable (up to the one loop approximation), it is discussed how a phase transition takes place as the temperature is increased and pass from spontaneously broken symmetry to a phase in which the symmetry is restored. (Author) [pt
Phase transition in SO(3) gauge theory
International Nuclear Information System (INIS)
Datta, Saumen; Gavai, Rajiv V.
1998-01-01
The phase transition in SO(3) lattice gauge theory is investigated by Monte Carlo techniques with a view (i) to understand the relationship between the bulk transition and the deconfinement transition, and (ii) to resolve the current ambiguity about the nature of the high temperature phase. By introduction of a magnetic field, it was shown that the +ve and -ve values of a > correspond to the same phase. Studies on different sized lattices lead to the conclusion that in SO(3), there is only one transition, which is deconfining in nature. (author)
Phase transitions in nonequilibrium traffic theory
Energy Technology Data Exchange (ETDEWEB)
Zhang, H.M.
2000-02-01
This paper uses the center difference scheme of Lax-Friedrichs to numerically solve a newly developed continuum traffic flow theory and the kinematic theory of Lighthill and Whitham, and Richards, and it studies the flow-concentration phase transitions in flow containing both shock and rarefaction waves. A homogeneous road with finite length was modeled by both theories. Numerical simulations show that both theories yield nearly identical results for two representative Riemann problems--one has a shock solution and the other a rarefaction wave solution. Their phase transition curves, however, are different: those derived from the new theory have two branches--one for acceleration flow and one for deceleration flow, whereas those derived from the LWR theory comprise a single curve--the equilibrium curve. The phase transition curves in the shock case agree well with certain experimental observations but disagree with others. This disagreement may be resolved by studying transitions among nonequilibrium states, which awaits further development of a more accurate finite difference approximation of the nonequilibrium theory.
Courtiol, Alexandre; Rickard, Ian J; Lummaa, Virpi; Prentice, Andrew M; Fulford, Anthony J C; Stearns, Stephen C
2013-05-20
Recent human history is marked by demographic transitions characterized by declines in mortality and fertility. By influencing the variance in those fitness components, demographic transitions can affect selection on other traits. Parallel to changes in selection triggered by demography per se, relationships between fitness and anthropometric traits are also expected to change due to modification of the environment. Here we explore for the first time these two main evolutionary consequences of demographic transitions using a unique data set containing survival, fertility, and anthropometric data for thousands of women in rural Gambia from 1956-2010. We show how the demographic transition influenced directional selection on height and body mass index (BMI). We observed a change in selection for both traits mediated by variation in fertility: selection initially favored short females with high BMI values but shifted across the demographic transition to favor tall females with low BMI values. We demonstrate that these differences resulted both from changes in fitness variance that shape the strength of selection and from shifts in selective pressures triggered by environmental changes. These results suggest that demographic and environmental trends encountered by current human populations worldwide are likely to modify, but not stop, natural selection in humans. Copyright © 2013 Elsevier Ltd. All rights reserved.
Lifetime reproduction and the second demographic transition: Stochasticity and individual variation
van Daalen, S.; Caswell, H.
2015-01-01
BACKGROUND In the last half of the previous century many developed countries went through a period of decreasing fertility rates, referred to as the second demographic transition. This transition is often measured using the Total Fertility Rate (TFR), which gives the mean number of children produced
Gillis, Artha J; Bath, Eraka
2016-01-01
There is a large proportion of minority youth involved in the juvenile justice system. Disproportionate minority contact (DMC) occurs when the proportion of any ethnic group is higher at any given stage in the juvenile justice process than the proportion of this group in the general population. There are several theories explaining the presence and persistence of DMC. This article reviews the history of DMC and the theories and implications of this problem. It discusses several targets for interventions designed to reduce DMC and offer resources in this area. Copyright © 2016 Elsevier Inc. All rights reserved.
How does variance in fertility change over the demographic transition?
Hruschka, Daniel J; Burger, Oskar
2016-04-19
Most work on the human fertility transition has focused on declines in mean fertility. However, understanding changes in the variance of reproductive outcomes can be equally important for evolutionary questions about the heritability of fertility, individual determinants of fertility and changing patterns of reproductive skew. Here, we document how variance in completed fertility among women (45-49 years) differs across 200 surveys in 72 low- to middle-income countries where fertility transitions are currently in progress at various stages. Nearly all (91%) of samples exhibit variance consistent with a Poisson process of fertility, which places systematic, and often severe, theoretical upper bounds on the proportion of variance that can be attributed to individual differences. In contrast to the pattern of total variance, these upper bounds increase from high- to mid-fertility samples, then decline again as samples move from mid to low fertility. Notably, the lowest fertility samples often deviate from a Poisson process. This suggests that as populations move to low fertility their reproduction shifts from a rate-based process to a focus on an ideal number of children. We discuss the implications of these findings for predicting completed fertility from individual-level variables. © 2016 The Author(s).
Hyperconifold transitions, mirror symmetry, and string theory
Davies, Rhys
2011-09-01
Multiply-connected Calabi-Yau threefolds are of particular interest for both string theorists and mathematicians. Recently it was pointed out that one of the generic degenerations of these spaces (occurring at codimension one in moduli space) is an isolated singularity which is a finite cyclic quotient of the conifold; these were called hyperconifolds. It was also shown that if the order of the quotient group is even, such singular varieties have projective crepant resolutions, which are therefore smooth Calabi-Yau manifolds. The resulting topological transitions were called hyperconifold transitions, and change the fundamental group as well as the Hodge numbers. Here Batyrev's construction of Calabi-Yau hypersurfaces in toric fourfolds is used to demonstrate that certain compact examples containing the remaining hyperconifolds — the Z and Z cases — also have Calabi-Yau resolutions. The mirrors of the resulting transitions are studied and it is found, surprisingly, that they are ordinary conifold transitions. These are the first examples of conifold transitions with mirrors which are more exotic extremal transitions. The new hyperconifold transitions are also used to construct a small number of new Calabi-Yau manifolds, with small Hodge numbers and fundamental group Z or Z. Finally, it is demonstrated that a hyperconifold is a physically sensible background in Type IIB string theory. In analogy to the conifold case, non-perturbative dynamics smooth the physical moduli space, such that hyperconifold transitions correspond to non-singular processes in the full theory.
Hyperconifold transitions, mirror symmetry, and string theory
International Nuclear Information System (INIS)
Davies, Rhys
2011-01-01
Multiply-connected Calabi-Yau threefolds are of particular interest for both string theorists and mathematicians. Recently it was pointed out that one of the generic degenerations of these spaces (occurring at codimension one in moduli space) is an isolated singularity which is a finite cyclic quotient of the conifold; these were called hyperconifolds. It was also shown that if the order of the quotient group is even, such singular varieties have projective crepant resolutions, which are therefore smooth Calabi-Yau manifolds. The resulting topological transitions were called hyperconifold transitions, and change the fundamental group as well as the Hodge numbers. Here Batyrev's construction of Calabi-Yau hypersurfaces in toric fourfolds is used to demonstrate that certain compact examples containing the remaining hyperconifolds - the Z 3 and Z 5 cases - also have Calabi-Yau resolutions. The mirrors of the resulting transitions are studied and it is found, surprisingly, that they are ordinary conifold transitions. These are the first examples of conifold transitions with mirrors which are more exotic extremal transitions. The new hyperconifold transitions are also used to construct a small number of new Calabi-Yau manifolds, with small Hodge numbers and fundamental group Z 3 or Z 5 . Finally, it is demonstrated that a hyperconifold is a physically sensible background in Type IIB string theory. In analogy to the conifold case, non-perturbative dynamics smooth the physical moduli space, such that hyperconifold transitions correspond to non-singular processes in the full theory.
Overview Chapter 6: The diverse faces of the Second Demographic Transition in Europe
Directory of Open Access Journals (Sweden)
Tomáš Sobotka
2008-07-01
Full Text Available This chapter discusses the concept of the second demographic transition (SDT and its relevance for explaining the ongoing changes in family and fertility patterns across Europe. It takes a closer look at the shifts in values and attitudes related to family, reproduction, and children, and their representation in different chapters in this collection. It re-examines the link between the second demographic transition and fertility, highlights its strong positive association with fertility at later childbearing ages, and suggests that the transition does not necessarily lead to sub-replacement fertility levels. Subsequently, it provides an extensive discussion on the progression of the SDT behind the former 'Iron Curtain.' To explain some apparent contradictions in this process, it employs a conceptual model of 'readiness, willingness, and ability' (RWA advocated by Lesthaeghe and Vanderhoeft (2001. It also explores the multifaceted nature of the second demographic transition between different social groups, and points out an apparent paradox: whereas lower-educated individuals often embrace values that can be characterised as rather traditional, they also frequently manifest family behaviour associated with the transition, such as non-marital childbearing, high partnership instability, and high prevalence of long-term cohabitation. This suggests that there may be two different pathways of the progression of the second demographic transition. The concluding section points out the role of structural constraints for the diffusion of the transition among disadvantaged social strata, highlights the importance of the 'gender revolution' for the SDT trends, and discusses the usefulness of the SDT framework.
Transition state theory for enzyme kinetics
Truhlar, Donald G.
2015-01-01
This article is an essay that discusses the concepts underlying the application of modern transition state theory to reactions in enzymes. Issues covered include the potential of mean force, the quantization of vibrations, the free energy of activation, and transmission coefficients to account for nonequilibrium effect, recrossing, and tunneling. PMID:26008760
Transition operators in electromagnetic-wave diffraction theory - General theory
Hahne, G. E.
1992-01-01
A formal theory is developed for the scattering of time-harmonic electromagnetic waves from impenetrable immobile obstacles with given linear, homogeneous, and generally nonlocal boundary conditions of Leontovich (impedance) type for the wave of the obstacle's surface. The theory is modeled on the complete Green's function and the transition (T) operator in time-independent formal scattering theory of nonrelativistic quantum mechanics. An expression for the differential scattering cross section for plane electromagnetic waves is derived in terms of certain matrix elements of the T operator for the obstacle.
Hyperconifold transitions, mirror symmetry, and string theory
Energy Technology Data Exchange (ETDEWEB)
Davies, Rhys, E-mail: daviesr@maths.ox.ac.uk [Mathematical Institute, University of Oxford, 24-29 St Giles, Oxford OX1 3LB (United Kingdom)
2011-09-01
Multiply-connected Calabi-Yau threefolds are of particular interest for both string theorists and mathematicians. Recently it was pointed out that one of the generic degenerations of these spaces (occurring at codimension one in moduli space) is an isolated singularity which is a finite cyclic quotient of the conifold; these were called hyperconifolds. It was also shown that if the order of the quotient group is even, such singular varieties have projective crepant resolutions, which are therefore smooth Calabi-Yau manifolds. The resulting topological transitions were called hyperconifold transitions, and change the fundamental group as well as the Hodge numbers. Here Batyrev's construction of Calabi-Yau hypersurfaces in toric fourfolds is used to demonstrate that certain compact examples containing the remaining hyperconifolds - the Z{sub 3} and Z{sub 5} cases - also have Calabi-Yau resolutions. The mirrors of the resulting transitions are studied and it is found, surprisingly, that they are ordinary conifold transitions. These are the first examples of conifold transitions with mirrors which are more exotic extremal transitions. The new hyperconifold transitions are also used to construct a small number of new Calabi-Yau manifolds, with small Hodge numbers and fundamental group Z{sub 3} or Z{sub 5}. Finally, it is demonstrated that a hyperconifold is a physically sensible background in Type IIB string theory. In analogy to the conifold case, non-perturbative dynamics smooth the physical moduli space, such that hyperconifold transitions correspond to non-singular processes in the full theory.
Karaman, I
1986-01-01
This is a historical survey of the process of modernization and the formulation of political and economic systems in Croatia, Yugoslavia, from the mid-nineteenth century to the present. Population dynamics and concurrent demographic transitions are addressed. (SUMMARY IN ENG AND RUS)
Partner relationships in the Netherlands: new manifestations of the Second Demographic Transition
Latten, J.J.; Mulder, C.H.
2013-01-01
Partnership formation has rapidly and profoundly changed in theNetherlandssince the 1960s.Several scholars have placed these changes in the context of the Second Demographic Transition. We describe the main trends in the formation and dissolution of partnerships in theNetherlandsbetween the
Partner relationships in the Netherlands : New manifestations of the Second Demographic Transition
Latten, Jan J.; Mulder, Clara H.
2013-01-01
Partnership formation has rapidly and profoundly changed in theNetherlandssince the 1960s.Several scholars have placed these changes in the context of the Second Demographic Transition. We describe the main trends in the formation and dissolution of partnerships in theNetherlandsbetween the
Directory of Open Access Journals (Sweden)
2004-04-01
Full Text Available The core issue in this article is the empirical tracing of the connection between a variety of value orientations and the life course choices concerning living arrangements and family formation. The existence of such a connection is a crucial element in the so-called theory of the Second Demographic Transition (SDT. The underlying model is of a recursive nature and based on two effects: firstly, values-based self-selection of individuals into alternative living arrangement or household types, and secondly, event-based adaptation of values to the newly chosen household situation. Any testing of such a recursive model requires the use of panel data. Failing these, only "footprints" of the two effects can be derived and traced in cross-sectional data. Here, use is made of the latest round of the European Values Surveys of 1999-2000, mainly because no other source has such a large selection of value items. The comparison involves two Iberian countries, three western European ones, and two Scandinavian samples. The profiles of the value orientations are based on 80 items which cover a variety of dimensions (e.g. religiosity, ethics, civil morality, family values, social cohesion, expressive values, gender role orientations, trust in institutions, protest proneness and post-materialism, tolerance for minorities etc.. These are analysed according to eight different household positions based on the transitions to independent living, cohabitation and marriage, parenthood and union dissolution. Multiple Classification Analysis (MCA is used to control for confounding effects of other relevant covariates (age, gender, education, economic activity and stratification, urbanity. Subsequently, Correspondence Analysis is used to picture the proximities between the 80 value items and the eight household positions. Very similar value profiles according to household position are found for the three sets of countries, despite the fact that the onset of the SDT in
Yu, Biying; Wei, Yi-Ming; Kei, Gomi; Matsuoka, Yuzuru
2018-02-01
Population dynamics has been acknowledged as a key concern for projecting future emissions, partly because of the huge uncertainties related to human behaviour. However, the heterogeneous shifts of human behaviour in the process of demographic transition are not well explored when scrutinizing the impacts of population dynamics on carbon emissions. Here, we expand the existing population-economy-environment analytical structure to address the above limitations by representing the trend of demographic transitions to small-family and ageing society. We specifically accommodate for inter- and intra-life-stage variations in time allocation and consumption in the population rather than assuming a representative household, and take a less developed province, Sichuan, in China as the empirical context. Our results show that the demographic shift to small and ageing households will boost energy consumption and carbon emissions, driven by the joint variations in time-use and consumption patterns. Furthermore, biased pictures of changing emissions will emerge if the time effect is disregarded.
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Barthélémy Kuate Defo
2014-05-01
Full Text Available Background: Studies of trends in population changes and epidemiological profiles in the developing world have overwhelmingly relied upon the concepts of demographic, epidemiological, and health transitions, even though their usefulness in describing and understanding population and health trends in developing countries has been repeatedly called into question. The issue is particularly relevant for the study of population health patterns in Africa and sub-Saharan Africa, as the history and experience there differs substantially from that of Western Europe and North America, for which these concepts were originally developed. Objective: The aim of this study is two-fold: to review and clarify any distinction between the concepts of demographic transition, epidemiological transition and health transition and to identify summary indicators of population health to test how well these concepts apply in Africa. Results: Notwithstanding the characteristically diverse African context, Africa is a continent of uncertainties and emergencies where discontinuities and interruptions of health, disease, and mortality trends reflect the enduring fragility and instability of countries and the vulnerabilities of individuals and populations in the continent. Africa as a whole remains the furthest behind the world's regions in terms of health improvements and longevity, as do its sub-Saharan African regions and societies specifically. This study documents: 1 theoretically and empirically the similarities and differences between the demographic transition, epidemiological transition, and health transition; 2 simple summary indicators that can be used to evaluate their descriptive and predictive features; 3 marked disparities in the onset and pace of variations and divergent trends in health, disease, and mortality patterns as well as fertility and life expectancy trajectories among African countries and regions over the past 60 years; 4 the rapid decline in infant
Kuate Defo, Barthélémy
2014-01-01
Background Studies of trends in population changes and epidemiological profiles in the developing world have overwhelmingly relied upon the concepts of demographic, epidemiological, and health transitions, even though their usefulness in describing and understanding population and health trends in developing countries has been repeatedly called into question. The issue is particularly relevant for the study of population health patterns in Africa and sub-Saharan Africa, as the history and experience there differs substantially from that of Western Europe and North America, for which these concepts were originally developed. Objective The aim of this study is two-fold: to review and clarify any distinction between the concepts of demographic transition, epidemiological transition and health transition and to identify summary indicators of population health to test how well these concepts apply in Africa. Results Notwithstanding the characteristically diverse African context, Africa is a continent of uncertainties and emergencies where discontinuities and interruptions of health, disease, and mortality trends reflect the enduring fragility and instability of countries and the vulnerabilities of individuals and populations in the continent. Africa as a whole remains the furthest behind the world's regions in terms of health improvements and longevity, as do its sub-Saharan African regions and societies specifically. This study documents: 1) theoretically and empirically the similarities and differences between the demographic transition, epidemiological transition, and health transition; 2) simple summary indicators that can be used to evaluate their descriptive and predictive features; 3) marked disparities in the onset and pace of variations and divergent trends in health, disease, and mortality patterns as well as fertility and life expectancy trajectories among African countries and regions over the past 60 years; 4) the rapid decline in infant mortality and gains
Kuate Defo, Barthélémy
2014-01-01
Studies of trends in population changes and epidemiological profiles in the developing world have overwhelmingly relied upon the concepts of demographic, epidemiological, and health transitions, even though their usefulness in describing and understanding population and health trends in developing countries has been repeatedly called into question. The issue is particularly relevant for the study of population health patterns in Africa and sub-Saharan Africa, as the history and experience there differs substantially from that of Western Europe and North America, for which these concepts were originally developed. The aim of this study is two-fold: to review and clarify any distinction between the concepts of demographic transition, epidemiological transition and health transition and to identify summary indicators of population health to test how well these concepts apply in Africa. Notwithstanding the characteristically diverse African context, Africa is a continent of uncertainties and emergencies where discontinuities and interruptions of health, disease, and mortality trends reflect the enduring fragility and instability of countries and the vulnerabilities of individuals and populations in the continent. Africa as a whole remains the furthest behind the world's regions in terms of health improvements and longevity, as do its sub-Saharan African regions and societies specifically. This study documents: 1) theoretically and empirically the similarities and differences between the demographic transition, epidemiological transition, and health transition; 2) simple summary indicators that can be used to evaluate their descriptive and predictive features; 3) marked disparities in the onset and pace of variations and divergent trends in health, disease, and mortality patterns as well as fertility and life expectancy trajectories among African countries and regions over the past 60 years; 4) the rapid decline in infant mortality and gains in life expectancy from the
The Effects of the Demographic Transition on Economic Growth : Implications for Japan
Sundman, Marie-Lor
2011-01-01
Demographic transition implies severe challenges for high income nations, for instance Japan, as the population decreases due to declines in birth rates as well as the higher rate of elderly population. More women are entering the labor market which affects birth rates. In addition, technological progress has improved health care and standard of living, bringing up life expectancies. However, the elderly population is increasing, elevating the dependency ratio which dampens the economic growt...
SINGAPORE'S DEMOGRAPHIC TRANSITION, THE LABOR FORCE AND GOVERNMENT POLICIES: THE LAST FIFTY YEARS
MUI TENG YAP; CHRISTOPHER GEE
2015-01-01
The trajectory of Singapore's population size and composition can be mapped out with its progression through the various phases of demographic transition from high birth and death rates in the post-war years to very low birth and death rates today, all within the context of rapid economic and social development that has taken place in the past 50 years. Population planning has been integral in Singapore's national development strategy, balancing the economy's needs for more and better qualifi...
Demographic transition and population ageing in India: Implications on the elderly of the future
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Shradha Mathur
2015-01-01
Full Text Available Ageing population of India will transform into the elderly in future. The issue of health of the elderly population in India has arrested the attention of health policy makers and the researchers, in the recent past. Demographic structure, quality of life, healthcare services and government planning have serious implications on the ageing population. The objective of the research article is to systematically and critically evaluate the impact of demographic transition, projected demographic indicators and changing population characteristics on the health status of the elderly persons living in India in the coming decades. Analysis and discussions are based on secondary data published by the Ministry of Health and Family Welfare of the Government of India. The results indicate that India will be an ageing nation in the coming years and improvements in health, education and government planning are likely to enhance the life expectancy of the elderly, while the share of children will reduce, suggesting an increase in dependency of the older persons on the adult population. The article provides insights into workable solutions and suggests key recommendations to attain faster demographic dividend. India would be competing with the pressure of a dramatic demographic bulge in future.
Demographic implications of socioeconomic transition among the tribal populations of Manipur, India.
Hemam, N S; Reddy, B M
1998-06-01
The demographic implications of socioeconomic transition are studied among the three subsistence categories of the Gangte, a little known tribe from northeast India. Reproductive histories of 444 ever-married women and other data on the 343 households from which these women were drawn were collected from 11 villages representing the 3 transitional groups. A trend of increasing household income and literacy of couples was observed from shifting cultivators to settled agriculturists to the town-dwelling Gangte. The effect of socioeconomic transition is also seen in the constriction at the base of the age-sex pyramid of the town dwellers compared with the other subsistence categories, suggesting a relatively lower proportion of children in the 0-5-year-old age group. Although exogamy is practiced among all the subsistence categories, a considerably higher percentage of admixture with non-Gangte is observed among the town dwellers compared with the others. Overall infant and child mortality among the Gangte is low. However, variation exists among the three subsistence groups in the sense that a considerable reduction is seen from the traditional shifting cultivators to the urbanized town dwellers, reflecting better socioeconomic conditions and greater awareness and accessibility of the town dwellers to public health amenities. No consistent or perceptible trend is evident in mean number of live births. The genetic implications of this demographic transition are reflected in Crow's indexes of selection.
Gifted Students in Transition: A Grounded Theory Study
Meadows, Jodi J.
2017-01-01
Gifted students in transition to college may be at risk for underachievement, difficult transition, or even attrition. Giftedness by itself is not always sufficient for academic success in college. The purpose of this grounded theory study was to construct a theory regarding the process of transition to college for high-achieving gifted high…
Detecting the Evolution of Deliberate Fertility Control before the Demographic Transition in Germany
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Aliaksandr Amialchuk
2012-10-01
Full Text Available BACKGROUND Pervious literature has established the existence of deliberate non-parity-specific fertility control in pre-transitional populations. However, less focus has been given to the timing of its onset. In addition, previous studies focused on the changes in fertility in response to the local prices of grains, which may be endogenous. OBJECTIVE This paper studies the emergence and evolution of deliberate fertility control by investigating the link between child mortality and economic stress on the one hand and non-parity-specific birth control on the other, in historic German villages between 1700 and 1900. METHODS Birth histories from fourteen German villages (1700-1900 and rye price series are used in a micro-level event history analysis. The fertility response of second and higher-order births to the mortality of children over age two and exogenous fluctuations in rye price are used as measures of the extent of deliberate non-parity-specific birth control. RESULTS Over the course of the demographic transition, the effect of the death of children generally increases after controlling for the effect of the death of children less than two years old. The negative fertility response to high rye prices before and in the year immediately following the price change occurred only after 1800. CONCLUSIONS The replacement and insurance effects associated with child mortality generally increased before the demographic transition. The emergence of the negative effect of high rye prices on fertility after 1800 further supports the presence and evolution of deliberate non-parity-specific fertility control before the demographic transition.
Situation-specific theories from the middle-range transitions theory.
Im, Eun-Ok
2014-01-01
The purpose of this article was to analyze the theory development process of the situation-specific theories that were derived from the middle-range transitions theory. This analysis aims to provide directions for future development of situation-specific theories. First, transitions theory is concisely described with its history, goal, and major concepts. Then, the approach that was used to retrieve the situation-specific theories derived from transitions theory is described. Next, an analysis of 6 situation-specific theories is presented. Finally, 4 themes reflecting commonalities and variances in the theory development process are discussed with implications for future theoretical development.
Directory of Open Access Journals (Sweden)
Sean S Downey
Full Text Available Analysis of the proportion of immature skeletons recovered from European prehistoric cemeteries has shown that the transition to agriculture after 9000 BP triggered a long-term increase in human fertility. Here we compare the largest analysis of European cemeteries to date with an independent line of evidence, the summed calibrated date probability distribution of radiocarbon dates (SCDPD from archaeological sites. Our cemetery reanalysis confirms increased growth rates after the introduction of agriculture; the radiocarbon analysis also shows this pattern, and a significant correlation between both lines of evidence confirms the demographic validity of SCDPDs. We analyze the areal extent of Neolithic enclosures and demographic data from ethnographically known farming and foraging societies and we estimate differences in population levels at individual sites. We find little effect on the overall shape and precision of the SCDPD and we observe a small increase in the correlation with the cemetery trends. The SCDPD analysis supports the hypothesis that the transition to agriculture dramatically increased demographic growth, but it was followed within centuries by a general pattern of collapse even after accounting for higher settlement densities during the Neolithic. The study supports the unique contribution of SCDPDs as a valid demographic proxy for the demographic patterns associated with early agriculture.
Demographic transition in sub-Saharan Africa: how big will the economic dividend be?
Eastwood, Robert; Lipton, Michael
2011-03-01
In mid-demographic-transition, many Asian countries enjoyed a large demographic 'dividend': extra economic growth owing to falling dependant/workforce ratios, or slower natural increase, or both. We estimate the dividend, 1985-2025, in sub-Saharan Africa and its populous countries. Dependency and natural increase peaked around 1985, 20 years after Asia. The UN projects an acceleration of the subsequent slow falls but disregards slowish declines in young-age mortality and thus, we argue, overestimates future fertility decline. Even if one accepts their projection, arithmetical and econometric evidence suggests an annual, if not total, dividend well below Asia's. The dividend arises more from falling dependency than reduced natural increase, and could be increased by accelerating the fertility decline (e.g., by reducing young-age mortality) or by employing a larger workforce productively. Any dividend from transition apart, low saving in much of Africa (unlike Asia) means that, given likely natural increase, current consumption per person is unsustainable because it depletes capital per person.
A Quantum Version of Wigner's Transition State Theory
Schubert, R.; Waalkens, H.; Wiggins, S.
A quantum version of a recent realization of Wigner's transition state theory in phase space is presented. The theory developed builds on a quantum normal form which locally decouples the quantum dynamics near the transition state to any desired order in (h) over bar. This leads to an explicit
A Quantum Version of Wigner’s Transition State Theory
Schubert, R.; Waalkens, H.; Wiggins, S.
2009-01-01
A quantum version of a recent realization of Wigner’s transition state theory in phase space is presented. The theory developed builds on a quantum normal form which locally decouples the quantum dynamics near the transition state to any desired order in ħ. This leads to an explicit algorithm to
Vibrational nonadiabaticity and tunneling effects in transition state theory
International Nuclear Information System (INIS)
Marcus, R.A.
1979-01-01
The usual quantum mechanical derivation of transition state theory is a statistical one (a quasi-equilibrium is assumed) or dynamical. The typical dynamical one defines a set of internal states and assumes vibrational adiabaticity. Effects of nonadiabaticity before and after the transition state are included in the present derivation, assuming a classical treatment of the reaction coordinate. The relation to a dynamical derivation of classical mechanical transition state theory is described, and tunneling effects are considered
Dimensions of Rational Decision-Making during the Demographic Transition; Aranjuez (Spain Revisited
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David Reher
2015-03-01
Full Text Available A set of linked reproductive histories taken from the Spanish town of Aranjuez during the demographic transition is used to address key issues regarding reproductive change and reproductive choice. This paper builds on the existing literature and especially on the findings first shown in Reher & Sanz-Gimeno (2007 and in Van Poppel et al. (2012 where the links between childhood survival and reproductive decision-making were specified. This paper goes beyond the original ones in two important ways: (a the sex composition of the surviving sibset is included in the analysis and (b behavior is modeled by means of event history analysis. In these models, controls for the survival status of the previous child are introduced so as to distinguish between biological factors related to the cessation of breastfeeding and both short term (child replacement and more long-term reproductive strategies. The results offer convincing proof that couples were continually regulating their fertility in order to achieve reproductive goals both in terms of net fertility and of the sex composition of the resulting sibset. Here results show that both sexes were desired by parents but that lack of surviving males had greater influence on fertility behavior. As expected, controls for the survival status of the previous-born child were important though they did not diminish appreciably the overall effect of the number of surviving offspring. This article offers strong proof for the existence of active decision-making during the demographic transition and applies a method to model these behaviors over the full reproductive history of the couple.
Fehren-Schmitz, Lars; Haak, Wolfgang; Mächtle, Bertil; Masch, Florian; Llamas, Bastien; Cagigao, Elsa Tomasto; Sossna, Volker; Schittek, Karsten; Isla Cuadrado, Johny; Eitel, Bernhard; Reindel, Markus
2014-07-01
Several archaeological studies in the Central Andes have pointed at the temporal coincidence of climatic fluctuations (both long- and short-term) and episodes of cultural transition and changes of socioeconomic structures throughout the pre-Columbian period. Although most scholars explain the connection between environmental and cultural changes by the impact of climatic alterations on the capacities of the ecosystems inhabited by pre-Columbian cultures, direct evidence for assumed demographic consequences is missing so far. In this study, we address directly the impact of climatic changes on the spatial population dynamics of the Central Andes. We use a large dataset of pre-Columbian mitochondrial DNA sequences from the northern Rio Grande de Nasca drainage (RGND) in southern Peru, dating from ∼840 BC to 1450 AD. Alternative demographic scenarios are tested using Bayesian serial coalescent simulations in an approximate Bayesian computational framework. Our results indicate migrations from the lower coastal valleys of southern Peru into the Andean highlands coincident with increasing climate variability at the end of the Nasca culture at ∼640 AD. We also find support for a back-migration from the highlands to the coast coincident with droughts in the southeastern Andean highlands and improvement of climatic conditions on the coast after the decline of the Wari and Tiwanaku empires (∼1200 AD), leading to a genetic homogenization in the RGND and probably southern Peru as a whole.
Quantifying the limits of transition state theory in enzymatic catalysis.
Zinovjev, Kirill; Tuñón, Iñaki
2017-11-21
While being one of the most popular reaction rate theories, the applicability of transition state theory to the study of enzymatic reactions has been often challenged. The complex dynamic nature of the protein environment raised the question about the validity of the nonrecrossing hypothesis, a cornerstone in this theory. We present a computational strategy to quantify the error associated to transition state theory from the number of recrossings observed at the equicommittor, which is the best possible dividing surface. Application of a direct multidimensional transition state optimization to the hydride transfer step in human dihydrofolate reductase shows that both the participation of the protein degrees of freedom in the reaction coordinate and the error associated to the nonrecrossing hypothesis are small. Thus, the use of transition state theory, even with simplified reaction coordinates, provides a good theoretical framework for the study of enzymatic catalysis. Copyright © 2017 the Author(s). Published by PNAS.
Random matrix theory for transition strengths: Applications and open questions
Kota, V. K. B.
2017-12-01
Embedded random matrix ensembles are generic models for describing statistical properties of finite isolated interacting quantum many-particle systems. A finite quantum system, induced by a transition operator, makes transitions from its states to the states of the same system or to those of another system. Examples are electromagnetic transitions (then the initial and final systems are same), nuclear beta and double beta decay (then the initial and final systems are different) and so on. Using embedded ensembles (EE), there are efforts to derive a good statistical theory for transition strengths. With m fermions (or bosons) in N mean-field single particle levels and interacting via two-body forces, we have with GOE embedding, the so called EGOE(1+2). Now, the transition strength density (transition strength multiplied by the density of states at the initial and final energies) is a convolution of the density generated by the mean-field one-body part with a bivariate spreading function due to the two-body interaction. Using the embedding U(N) algebra, it is established, for a variety of transition operators, that the spreading function, for sufficiently strong interactions, is close to a bivariate Gaussian. Also, as the interaction strength increases, the spreading function exhibits a transition from bivariate Breit-Wigner to bivariate Gaussian form. In appropriate limits, this EE theory reduces to the polynomial theory of Draayer, French and Wong on one hand and to the theory due to Flambaum and Izrailev for one-body transition operators on the other. Using spin-cutoff factors for projecting angular momentum, the theory is applied to nuclear matrix elements for neutrinoless double beta decay (NDBD). In this paper we will describe: (i) various developments in the EE theory for transition strengths; (ii) results for nuclear matrix elements for 130Te and 136Xe NDBD; (iii) important open questions in the current form of the EE theory.
Localization transition in SU(3) gauge theory
Kovács, Tamás G.; Vig, Réka Á.
2018-01-01
We study the Anderson-like localization transition in the spectrum of the Dirac operator of quenched QCD. Above the deconfining transition we determine the temperature dependence of the mobility edge separating localized and delocalized eigenmodes in the spectrum. We show that the temperature where the mobility edge vanishes and localized modes disappear from the spectrum coincides with the critical temperature of the deconfining transition. We also identify topological charge related close to zero modes in the Dirac spectrum and show that they account for only a small fraction of localized modes, a fraction that is rapidly falling as the temperature increases.
Scaling theory and the classification of phase transitions
International Nuclear Information System (INIS)
Hilfer, R.
1992-01-01
In this paper, the recent classification theory for phase transitions and its relation with the foundations of statistical physics is reviewed. First it is outlined how Ehrenfests classification scheme can be generalized into a general thermodynamic classification theory for phase transitions. The classification theory implies scaling and multiscaling thereby eliminating the need to postulate the scaling hypothesis as a fourth law of thermodynamics. The new classification has also led to the discovery and distinction of nonequilibrium transitions within equilibrium statistical physics. Nonequilibrium phase transitions are distinguished from equilibrium transitions by orders less than unity and by the fact the equilibrium thermodynamics and statistical mechanics become inapplicable at the critical point. The latter fact requires a change in the Gibbs assumption underlying the canonical and grandcanonical ensembles in order to recover the thermodynamic description in the critical limit
Heavy quark effective theory and heavy baryon transitions
International Nuclear Information System (INIS)
Hussain, F.
1992-01-01
The heavy quark effective theory (HQET) is applied to study the weak decay of heavy mesons and heavy baryons and to predict the form factors for heavy to heavy and heavy to light transitions. 28 refs, 10 figs, 2 tabs
Theory of coherent transition radiation generated by ellipsoidal electron bunches
Root, op 't W.P.E.M.; Smorenburg, P.W.; Oudheusden, van T.; Wiel, van der M.J.; Luiten, O.J.
2007-01-01
We present the theory of coherent transition radiation (CTR) generated by ellipsoidal electron bunches. We calculate analytical expressions for the electric field spectrum, the power spectrum, and the temporal electric field of CTR, generated by cylindrically symmetric ellipsoidal electron bunches
Z3 - invariant effective theory of deconfining phase transition
International Nuclear Information System (INIS)
So, Hiroto
1986-01-01
A Z 3 -invariant scalar model is proposed as an effective theory of deconfining phase transition of QCD. Coupling constants in the potential are determined by Monte Carlo methods. The structure of renormalization trajectories for coupling constants is investigated. (author)
Theory of Microcrediting in Transitional Economies
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Nikola Kadoić
2009-06-01
Full Text Available In the early 1970s, Bangladeshi banker and economist Dr. Muhammad Yunus designed microcrediting – a socially sensitive and rightful system of fighting poverty and high unemployment rates. His Grameen Bank for the poorest of the poor in Bangladesh has so far lifted more than 3.2 million of individuals and their families out of poverty. After initial successes at home, microcredit was put into service for reducing unemployment and alleviating poverty in numerous countries throughout the world. This paper explores specific problems that a typical transitional country (like Croatia, is likely to face, with unemployment – the source of a vast number of related problems in a transitional society – as the focal point. The authors have attempted to incorporate particularities of a transitional economy into the original microcrediting principles. As a solution to problems afflicting the domestic economy, the authors define a global microcrediting system framework on the macroeconomic level, assuming at the same time that microcrediting of socially vulnerable groups can resolve many problems of modern transitional societies. Arising from the authors' primary intention – to consider in depth the functionality of microcrediting in general transition conditions – a transitional microcrediting system has been defined in general terms, and a corresponding financial and mathematical model developed.
Theory of the transition temperature of superconducting amorphous transition metals
International Nuclear Information System (INIS)
Zwicknagel, G.
1979-11-01
In the present paper first the transition temperature Tsub(c) is shown to be a local quantity, which depends on the (average) short range order, and second it is demonstrated how to calculate local electronic properties in the framework of a short range order model and the transition temperature of amorphous systems based on accepted structure models of the amorphous state. In chapter I the theoretical basis of this work is presented in brief. The model used to study the role of short range order (in periodically ordered as well as in disordered system) is described in chapter II. The results of this model for the periodically ordered case are compared in chapter III with band structure calculations. In chapter IV it is shown how to establish short range order models for disordered systems and what kind of information can be obtained with respect to the electronic properties. Finally in chapter V it is discussed to what extend the interpretation of the transition temperature Tsub(c) as being determined by short range order effects can be supported by the electronic properties, which are calculated in the chapters III and IV. (orig.) [de
Ab initio theory of helix <-> coil phase transition
DEFF Research Database (Denmark)
Yakubovich, Alexander V.; Solov'yov, Ilia; Solov'yov, Andrey V.
2008-01-01
In this paper, we suggest a theoretical method based on the statistical mechanics for treating the alpha-helix <-> random coil transition in alanine polypeptides. We consider this process as a first-order phase transition and develop a theory which is free of model parameters and is based solely ...
Theory of free-bound transitions in channeling radiation
International Nuclear Information System (INIS)
Saenz, A.W.; Nagl, A.; Uberall, H.
1988-01-01
On the basis of a single-string model, we derive formulas for the transition strengths of free-bound transitions of axially channeled electrons. We illustrate the theory by numerical calculations of these strengths for 3.5-MeV electrons in Si. Experimental evidence for such transitions has been obtained previously [J.U. Andersen et al., Nucl. Instrum. Methods 194, 209 (1982)] and is in good qualitative agreement with our calculations
LH transition theories and theory of H-mode
International Nuclear Information System (INIS)
Ward, D.J.
1996-01-01
Recent developments in H-mode theory are discussed with earlier work described to put new theories in context. Much of the recent work concerns the development of the radial electric field near the plasma edge and its impact on transport driven by fluctuations, and is the main topic discussed. (author)
Bovolenta, Tânia M; Felicio, Andre C
2017-01-01
Brazil is currently experiencing a significant demographic transition characterized by a decrease in fertility rates and an exponential increase in the number of elderly citizens, which presents a special challenge for the health care professionals. More than other portions of the population, the elderly are most commonly affected by chronic diseases such as Parkinson's disease. Policymakers contend that Brazil is reasonably well-prepared regarding elderly health care, with policies that aim to ensure the quality of life and the well-being of this portion of the population. However, what happens in practice falls short of what the Brazilian Constitution sets forth. Specifically, there is a clear contradiction between what the law recognizes as being a citizen's rights and the implementation of guidelines. Because health financing in Brazil remains relatively low, the civil society tries to fill in the gaps as much as possible in the treatment of elderly patients suffering from chronic diseases such as Parkinson's disease. In this review, we outline the current legislation in Brazil regarding the elderly and in particular, patients with Parkinson's disease, in the context of a rapidly aging population.
Nonperturbative approach to quantum field theories: phase transitions and confinement
International Nuclear Information System (INIS)
Yankielowicz, S.
1976-08-01
Lectures are given on a nonperturbative approach to quantum field theories. Phenomena are discussed for which the usual weak coupling perturbative approach in terms of Feynman diagrams is of no assistance. Properties associated with large distance behavior, i.e., phase transitions, low lying spectra, coherent excitations which are presumably built out of the long wave structure of the theory are described. These methods are important for the study of strong coupling field theories and the question of quarks confinement. 25 references
Explore Stochastic Instabilities of Periodic Points by Transition Path Theory
Cao, Yu; Lin, Ling; Zhou, Xiang
2016-06-01
We consider the noise-induced transitions from a linearly stable periodic orbit consisting of T periodic points in randomly perturbed discrete logistic map. Traditional large deviation theory and asymptotic analysis at small noise limit cannot distinguish the quantitative difference in noise-induced stochastic instabilities among the T periodic points. To attack this problem, we generalize the transition path theory to the discrete-time continuous-space stochastic process. In our first criterion to quantify the relative instability among T periodic points, we use the distribution of the last passage location related to the transitions from the whole periodic orbit to a prescribed disjoint set. This distribution is related to individual contributions to the transition rate from each periodic points. The second criterion is based on the competency of the transition paths associated with each periodic point. Both criteria utilize the reactive probability current in the transition path theory. Our numerical results for the logistic map reveal the transition mechanism of escaping from the stable periodic orbit and identify which periodic point is more prone to lose stability so as to make successful transitions under random perturbations.
Modern aspects of the kinetic theory of glass transition
International Nuclear Information System (INIS)
Tropin, T V; Aksenov, V L; Schmelzer, J W
2016-01-01
This paper reviews glass transition kinetics models that are developed to describe the formation of structural (for example, covalent and metallic) glasses, as well as to account for the transition of a polymer to a solid glassy state. As the two approaches most frequently used over the last decade to model the glass transition, the Tool–Narayanaswamy–Moynihan model and the Adam–Gibbs theory of glass transition are described together with examples of their applications. Also discussed are entropy-based approaches that rely on irreversible thermodynamics methods originated in the work of De Donder, Mandelstam, and Leontovich. The actual problems that arise in applying these methods and the prospects of their development are discussed. A brief overview of statistical glass transition models is given, including the mode-coupling and energy-landscape theories. (reviews of topical problems)
Deconfinement and the Hagedorn transition in string theory.
Chaudhuri, S
2001-03-05
We introduce a new definition of the thermal partition function in string theory. With this new definition, the thermal partition functions of all of the string theories obey thermal duality relations with self-dual Hagedorn temperature beta(2)(H) = 4pi(2)alpha('). A beta-->beta(2)(H)/beta transformation maps the type I theory into a new string theory (type I) with thermal D p-branes, spatial hypersurfaces supporting a p-dimensional finite temperature non-Abelian Higgs-gauge theory for p< or =9. We demonstrate a continuous phase transition in the behavior of the static heavy quark-antiquark potential for small separations r(2)(*)
Linking Complexity and Sustainability Theories: Implications for Modeling Sustainability Transitions
Directory of Open Access Journals (Sweden)
Camaren Peter
2014-03-01
Full Text Available In this paper, we deploy a complexity theory as the foundation for integration of different theoretical approaches to sustainability and develop a rationale for a complexity-based framework for modeling transitions to sustainability. We propose a framework based on a comparison of complex systems’ properties that characterize the different theories that deal with transitions to sustainability. We argue that adopting a complexity theory based approach for modeling transitions requires going beyond deterministic frameworks; by adopting a probabilistic, integrative, inclusive and adaptive approach that can support transitions. We also illustrate how this complexity-based modeling framework can be implemented; i.e., how it can be used to select modeling techniques that address particular properties of complex systems that we need to understand in order to model transitions to sustainability. In doing so, we establish a complexity-based approach towards modeling sustainability transitions that caters for the broad range of complex systems’ properties that are required to model transitions to sustainability.
Some aspects of transition radiation and scattering theory
International Nuclear Information System (INIS)
Ginzburg, V.L.; Tsytovich, V.N.
1978-01-01
Some aspects of transition radiation and transition scattering theory are considered. The transition radiation in vacuum is analysed in the presence of a strong magnetic field. It is shown, that the constant electro-magnetic field makes vacuum similar to the uniaxial ferrodielectric. The appearance of the transition radiation in the nonstationary medium is discussed when its properties in the medium change abruptly in time. It is obtained, that both types of the transition radiation for nonrelativistic particles (on an abrupt boundary of the two media interface and under an abrupt change in time of the medium properties) differ quantitatively (on the order of the value). The role of the radiation transition and scattering in plasma physics has been elucidated from different points. Four most important features of these processes are pointed out. Particularly, essential is shown to be the type of the transition scattering when one plasma wave, being the dielectric constant wave transforms into another one also a plasma wave. In the processes of the transition scattering an essential part is played by the effects of the space dispersion, particularly when the scattering takes place on the small velocity particles. Finally besides transition scattering there exists in plasma or in some cases prevails a Thomson scattering. In this case an important role in plasma is played by the interference between the Thomson and the transition scattering
Reservoir theory, groundwater transit time distributions, and lumped parameter models
International Nuclear Information System (INIS)
Etcheverry, D.; Perrochet, P.
1999-01-01
The relation between groundwater residence times and transit times is given by the reservoir theory. It allows to calculate theoretical transit time distributions in a deterministic way, analytically, or on numerical models. Two analytical solutions validates the piston flow and the exponential model for simple conceptual flow systems. A numerical solution of a hypothetical regional groundwater flow shows that lumped parameter models could be applied in some cases to large-scale, heterogeneous aquifers. (author)
The 'silent' phase transition in mesonic bags and lattice theory
International Nuclear Information System (INIS)
Dey, J.; Dey, M.; Araujo Junior, C.F. de; Tomio, L.
1993-10-01
It is shown that even the simple bag model is able to reproduce the lattice result for the masses and the sound velocity, at finite temperature, T, suggests that the transition point depends on the nature of the meson. It would be interesting to check the last conclusion in present day finite temperature lattice theory, since different transition points seem to be indicated by particle emission T in heavy ion reactions. (author)
Towards the theory of the electroweak phase transition
International Nuclear Information System (INIS)
Dine, M.; Leigh, R.G.; Huet, P.; Linde, A.; Linde, D.
1992-01-01
We investigate various problems related to the theory of the electroweak phase transition. This includes determination of the nature of the phase transition, discussion of the possible role of the higher-order radiative corrections, and the theory of the formation and evolution of bubbles of the new phase. We show, in particular, that no dangerous linear terms in the scalar field φ appear in the expression for the effective potential. We have found that, for the Higgs-boson mass smaller than the masses of W and Z bosons, the phase transition is of the first order. However, its strength is approximately 2/3 times less than what follows from the one-loop approximation. The phase transition occurs due to production and expansion of critical bubbles. Subcritical bubbles may be important only if the phase transition is very weakly first order. A general analytic expression for the probability of the bubble formation is obtained, which may be used for study of tunneling in a wide class of theories. The bubble-wall velocity depends on many factors, including the ratio of the mean free path of the particles to the thickness of the wall. Thin walls in the electroweak theory have a nonrelativistic velocity, whereas thick walls may be relativistic. A decrease of the cubic term by the factor 2/3 rules our baryogenesis in the minimal version of the electroweak theory. Even though we concentrate in this paper on the phase transition in this theory, most of our results can be applied to more general models as well, where baryogenesis is possible
The role of demographic compensation theory in incidental take assessments for endangered species
McGowan, Conor P.; Ryan, Mark R.; Runge, Michael C.; Millspaugh, Joshua J.; Cochrane, Jean Fitts
2011-01-01
Many endangered species laws provide exceptions to legislated prohibitions through incidental take provisions as long as take is the result of unintended consequences of an otherwise legal activity. These allowances presumably invoke the theory of demographic compensation, commonly applied to harvested species, by allowing limited harm as long as the probability of the species' survival or recovery is not reduced appreciably. Demographic compensation requires some density-dependent limits on survival or reproduction in a species' annual cycle that can be alleviated through incidental take. Using a population model for piping plovers in the Great Plains, we found that when the population is in rapid decline or when there is no density dependence, the probability of quasi-extinction increased linearly with increasing take. However, when the population is near stability and subject to density-dependent survival, there was no relationship between quasi-extinction probability and take rates. We note however, that a brief examination of piping plover demography and annual cycles suggests little room for compensatory capacity. We argue that a population's capacity for demographic compensation of incidental take should be evaluated when considering incidental allowances because compensation is the only mechanism whereby a population can absorb the negative effects of take without incurring a reduction in the probability of survival in the wild. With many endangered species there is probably little known about density dependence and compensatory capacity. Under these circumstances, using multiple system models (with and without compensation) to predict the population's response to incidental take and implementing follow-up monitoring to assess species response may be valuable in increasing knowledge and improving future decision making.
Directory of Open Access Journals (Sweden)
Юрий Аркадьевич Григорьев
2017-09-01
Full Text Available From the general positions of population dynamics, the demographic policy is considered, its regional features in the East of Russia are designated. It is necessary to consolidate the positive traditions of the moral and legal norms of the society and the harmonious personality development. It takes their long-term translation for the improvement of the person himself, his family-marriage relations to support the forms of demographic behavior aimed at the expanded population reproduction. The solution of the numerous tasks of the demographic policy presupposes further scientific (theoretical and applied studies of the features of the socio-demographic and medico-demographic development of the Russian regions. Particular attention should be paid to the analysis of the main characteristics of the epidemiological transition, where mortality, as well as birth rate, is one of the main characteristics of the population reproduction. This will make it possible to define more precisely the prediction of the value of irretrievable losses with endogenous and exogenous determination, to estimate on this basis the reserves of increasing life expectancy through the measures of demographic policy.
Transition matrices and orbitals from reduced density matrix theory
Energy Technology Data Exchange (ETDEWEB)
Etienne, Thibaud [Université de Lorraine – Nancy, Théorie-Modélisation-Simulation, SRSMC, Boulevard des Aiguillettes 54506, Vandoeuvre-lès-Nancy (France); CNRS, Théorie-Modélisation-Simulation, SRSMC, Boulevard des Aiguillettes 54506, Vandoeuvre-lès-Nancy (France); Unité de Chimie Physique Théorique et Structurale, Université de Namur, Rue de Bruxelles 61, 5000 Namur (Belgium)
2015-06-28
In this contribution, we report two different methodologies for characterizing the electronic structure reorganization occurring when a chromophore undergoes an electronic transition. For the first method, we start by setting the theoretical background necessary to the reinterpretation through simple tensor analysis of (i) the transition density matrix and (ii) the natural transition orbitals in the scope of reduced density matrix theory. This novel interpretation is made more clear thanks to a short compendium of the one-particle reduced density matrix theory in a Fock space. The formalism is further applied to two different classes of excited states calculation methods, both requiring a single-determinant reference, that express an excited state as a hole-particle mono-excited configurations expansion, to which particle-hole correlation is coupled (time-dependent Hartree-Fock/time-dependent density functional theory) or not (configuration interaction single/Tamm-Dancoff approximation). For the second methodology presented in this paper, we introduce a novel and complementary concept related to electronic transitions with the canonical transition density matrix and the canonical transition orbitals. Their expression actually reflects the electronic cloud polarisation in the orbital space with a decomposition based on the actual contribution of one-particle excitations from occupied canonical orbitals to virtual ones. This approach validates our novel interpretation of the transition density matrix elements in terms of the Euclidean norm of elementary transition vectors in a linear tensor space. A proper use of these new concepts leads to the conclusion that despite the different principles underlying their construction, they provide two equivalent excited states topological analyses. This connexion is evidenced through simple illustrations of (in)organic dyes electronic transitions analysis.
Renormalization group theory of phase transitions in square Ising systems
International Nuclear Information System (INIS)
Nienhuis, B.
1978-01-01
Some renormalization group calculations are presented on a number of phase transitions in a square Ising model, both second and first order. Of these transitions critical exponents are calculated, the amplitudes of the power law divergences and the locus of the transition. In some cases attention is paid to the thermodynamic functions also far from the critical point. Universality and scaling are discussed and the renormalization group theory is reviewed. It is shown how a renormalization transformation, which relates two similar systems with different macroscopic dimensions, can be constructed, and how some critical properties of the system follow from this transformation. Several numerical and analytical applications are presented. (Auth.)
The high temperature phase transition for the φ4 theory
International Nuclear Information System (INIS)
Tetradis, N.
1994-01-01
The use of the perturbative temperature dependent effective potential for the study of second order or weakly first order phase transitions is problematic, due to the appearance of infrared divergences. These divergences can be controlled through the method of the effective average action which employs renormalization group ideas. I review work done with C. Wetterich on the study of the high temperature phase transition for the N-component Φ 4 theory. A detailed quantitative picture of the second order phase transition is presented, including the critical exponents for the behaviour in the vicinity of the critical temperature. (orig.)
Theory of K-MM radiative-Auger transitions
International Nuclear Information System (INIS)
Baptista, G.B.
1975-01-01
Presently available calculations of transition probabilities for radiative-Auger and double-Auger processes are based on shake-off theory. In this theory, such processes are thought of as being due to electron core rearrangement associated with de-excitation of an inner shell vacancy. It is suggested that radiative-Auger processes result from the interaction of two electrons with one another and the radiation field in the presence of an inner shell vacancy, while double-Auger processes result from the interaction of an electron with two electrons in the presence of a similar vacancy. Expressions for the transition probabilities of these processes are derived in second order time dependent perturbation theory. The interaction is taken as the sum of the Coulomb interaction and electron-field interaction of the electrons involved. This approach allows calculation of the detailed photon or electron energy distribution resulting from such processes, as well as the relative and absolute transition rates involved. As a specific example of this approach the transition probability for the K-MM radiative-Auger effect in argon is calculated and compared with available experimental data. Scaled Thomas-Fermi wavefunctions are used to calculate the total transition probability which is found to be 2.68 x 10 -4 eV/h-bar In addition, the spectral distribution of emitted photons is obtained, and agreement both in magnitude and with the general features of the experimental data is excellent
Phase transitions at finite chemical potential in grand unified theories
International Nuclear Information System (INIS)
Bailin, D.; Love, A.
1984-01-01
We discuss the circumstances in which non-zero chemical potentials might prevent symmetry restoration in phase transitions in the early universe at grand unification or partial unification scales. The general arguments are illustrated by consideration of SO(10) and SU(5) grand unified theories. (orig.)
Ignition And Transition Conditions In The Theory Of Combustion ...
African Journals Online (AJOL)
In branched-chain thermal explosion theory, it is usually impossible analytically and sometimes a substantial computation to calculate the temperature, activation energy and modiûed Semenov's number at transition from discontinuous to continuous behaviour. Invariably, it is possible to reduce the governing equation to ...
Phase transitions and topological excitations in hypergauge theories
International Nuclear Information System (INIS)
Nencka-Ficek, H.
1985-01-01
The problems connected with the phase structure of antisymmetric tensor gauge fields are investigated. (s+1)-dimensional hyperloops cannot be constructed in (s+1)-dimensional lattices. This is the cause of a lack of phase transitions in the U(1) theories with fields being sth-kind gauge invariant in the (s+1)-dimensional lattice
Directory of Open Access Journals (Sweden)
Petrović Mina
2011-01-01
Full Text Available The paper starts by questioning the theory of second demographic transition (SDT and its universal relevance in the field of marriage behavior and family organization in low fertility context, arguing for more differentiated approaches. With an aim to illustrate the contextual specifics of post-socialist countries in general and of Serbia in particular, the author claims that analyzed changes have not just been delayed or incomplete in comparison to more developed European countries, but shaped by specific modernization processes, which led to rationally developed strategies in overcoming structural risks, although, without ideational changes typical to the theory of SDT. Slow changes in marital behavior and family organization in Serbia are illustrated in recent sociological (empirical research findings. The perceived changes are linked to specific structural risks (war, slow transformation and enduring economic hardships, weak state and low trust in institutions, etc and value characteristics (persistence of materialism and traditionalism, but with increasing ambivalence. The connection between structural and ideational changes is considered through social stratification variable by relying on Coale's model on necessary preconditions for behavioral changes as well as on social deprivation concept. Having in mind upper social strata (more educated and better off, the value changes precede the behavioral that are adapted to economic uncertainty, which still force more traditional marital and family patterns. Therefore, there is a rank of different options, from extended family (for a short period at the beginning of marriage or after divorce to separated leaving (of married partners in parental households (due to refusing the extended family option thus creating quite specific "living apart together" form, combined with dominant strategy of prolonging the marriage. Hence, for upper social strata, marriage is still a universal but negotiable
Correlated effective field theory in transition metal compounds
International Nuclear Information System (INIS)
Mukhopadhyay, Subhasis; Chatterjee, Ibha
2004-01-01
Mean field theory is good enough to study the physical properties at higher temperatures and in higher dimensions. It explains the critical phenomena in a restricted sense. Near the critical temperatures, when fluctuations become important, it may not give the correct results. Similarly in low dimensions, the correlations become important and the mean field theory seems to be inadequate to explain the physical phenomena. At low-temperatures too, the quantum correlations become important and these effects are to be treated in an appropriate way. In 1974, Prof. M.E. Lines of Bell Laboratories, developed a theory which goes beyond the mean field theory and is known as the correlated effective field (CEF) theory. It takes into account the fluctuations in a semiempirical way. Lines and his collaborators used this theory to explain the short-range correlations and their anisotropy in the paramagnetic phase. Later Suzuki et al., Chatterjee and Desai, Mukhopadhyay and Chatterjee applied this theory to the magnetically ordered phase and a tremendous success of the theory has been found in real systems. The success of the CEF theory is discussed in this review. In order to highlight the success of this theory, earlier effective field theories and their improvements over mean field theories e.g., Bethe-Peierls-Weiss method, reaction field approximation, etc., are also discussed in this review for completeness. The beauty of the CEF theory is that it is mean field-like, but captures the essential physics of real systems to a great extent. However, this is a weak correlated theory and as a result is inappropriate for the metallic phase when strong correlations become important. In recent times, transition metal oxides become important due to the discovery of the high-temperature superconductivity and the colossal magnetoresistance phenomena. These oxides seem to be Mott insulators and undergo an insulator to metal transition by applying magnetic field, pressure and by changing
Wang, Yingning; Sung, Hai-Yen; Yao, Tingting; Lightwood, James; Max, Wendy
2016-01-01
Aims To examine the transitions in smoking status among nondaily smokers who transitioned to daily or former smokers or remained as nondaily smokers over a 12-month period. We analyzed factors associated with these transitions, including the use of cigars and smokeless tobacco (SLT). Design Secondary data analyses using pooled data from the 2003, 2006/07 and 2010/11 Tobacco Use Supplements to the Current Population Survey (TUS-CPS). Setting USA Participants Self-respondents aged 18+ who have smoked for more than 5 years and were nondaily smokers 12 months before the interview (n = 13,673 or 14.5% of current smokers). Measurements Multinomial logistic regression model to determine the correlates of nondaily-to-daily, stable nondaily, and nondaily-to-former smoking transitions among nondaily smokers at baseline. The model controlled for socio-demographic factors and the use of cigars and SLT. Findings 2.6% of adults in our sample were nondaily smokers at baseline. Among these, 69.7% remained nondaily smokers (stable nondaily smokers), 18.4% became daily smokers (nondaily-to-daily smokers), and 11.9% quit smoking (nondaily-to-former smokers) after 12 months. The nondaily-to-daily vs. stable nondaily smoking transition was less likely among those who were aged 65+ (p=0.018), male (pnon-Hispanic Asian (p=0.032), without a college degree, widowed/divorced/separated (p=0.013) or never married (p=0.011), and current users of cigars (p=0.003) compared with the appropriate reference group. Conclusions While over two-thirds of nondaily smokers in the USA remain as such after 12 months, others become daily smokers or quit. The likelihood of remaining stable nondaily smokers and of transition from nondaily-to-daily and nondaily-to-former smokers is associated with socio-demographics factors and current use of cigars and smokeless tobacco. PMID:27886652
Several problems of the theory of transition radiation and transition scattering
International Nuclear Information System (INIS)
Ginzburg, V.L.; Tsytovich, V.N.
1979-01-01
The process of transition radiation is a very general one. It appears if some source, which does not have a proper frequency (for example a point charge, multipole etc), is moving with a constant velocity in an inhomogeneous and/or nonstationary medium. In the case of a periodic medium the transition radiation has some special peculiarities and is called the resonance transition radiation or transition scattering. Transition scattering occurs particularly in the case when some wave of dielectric permittivity acts on a nonmoving (fixed) charge. The processes of transition radiation and transition scattering have analogies outside electrodynamics similarly to the Vavilov-Cherenkov emission. The latter occurs also for a source moving with a constant velocity but in a homogeneous medium (and only if the velocity of the source exceeds the wave phase velocity in the medium). The present review is dealing with several problems of the theory of transition radiation and transition scattering. Attention is paid mainly to the formulation of the problems and to revealing characterisic features and peculiarities of the phenomena described. (Auth.)
Directory of Open Access Journals (Sweden)
Anke Matuschewski
2016-01-01
Full Text Available This article aims to critically assess the economic growth paradigm, which typically underlies most approaches to regional policymaking for demographic change. While population losses, ageing and outmigration – i.e. phenomena that are addressed as demographic change – have become a matter of urgency for many European regions, most regional economic development theories remain silent about the population decline affecting the economic growth and development prospects of regions. Consequently, regional policies usually rely on the concept of economic growth, yet neglect the complexity and importance of demographic change and how it relates to the economic sphere. Due to this lack in nuance, we argue that regional policymaking fails to design adequate policy support for regions facing persistent demographic change and economic stagnation or decline as a result. Based on these observations, the paper examines a selection of regional economic development theories in search for alternative concepts of growth and development in the context of demographic change. To this aim, globalisation peripheries are introduced as a fruitful conceptual point of reference and, in combination with endogenous regional development theories, discussed as an alternative approach for regional policymaking.
Wichtl, T
1985-01-01
"This essay focuses on mercantilist theories and interpretations of demographic trends [in Austria] in the late 18th century." The writings of several mercantilist authors are summarized, and the influence of their views on population policy is discussed. It is noted that the official population policy, which aimed at fast population growth to strengthen the economy and increase the number of soldiers, was based on the mercantilist theory that greater population size means higher per capita incomes. (summary in ENG) excerpt
Internal conversion coefficients of high multipole transitions: Experiment and theories
International Nuclear Information System (INIS)
Gerl, J.; Vijay Sai, K.; Sainath, M.; Gowrishankar, R.; Venkataramaniah, K.
2008-01-01
A compilation of the available experimental internal conversion coefficients (ICCs), α T , α K , α L , and ratios K/L and K/LM of high multipole (L > 2) transitions for a number of elements in the range 21 ≤ Z ≤ 94 is presented. Our listing of experimental data includes 194 data sets on 110 E3 transitions, 10 data sets on 6 E4 transitions, 11 data sets on 7 E5 transitions, 38 data sets on 21 M3 transitions, and 132 data sets on 68 M4 transitions. Data with less than 10% experimental uncertainty have been selected for comparison with the theoretical values of Hager and Seltzer [R.S. Hager, E.C. Seltzer, Nucl. Data Tables A 4 (1968) 1], Rosel et al. [F. Roesel, H.M. Fries, K. Alder, H.C. Pauli, At. Data Nucl. Data Tables 21 (1978) 91], and BRICC. The relative percentage deviations (%Δ) have been calculated for each of the above theories and the averages (%Δ-bar) are estimated. The Band et al. [I.M. Band, M.B. Trzhaskovskaya, C.W. Nestor Jr., P.O. Tikkanen, S. Raman, At. Data Nucl. Data Tables 81 (2002) 1] tables, using the BRICC interpolation code, are seen to give theoretical ICCs closest to experimental values
Transition theory and its relevance to patients with chronic wounds.
Neil, J A; Barrell, L M
1998-01-01
A wound, in the broadest sense, is a disruption of normal anatomic structure and function. Acute wounds progress through a timely and orderly sequence of repair that leads to the restoration of functional integrity. In chronic wounds, this timely and orderly sequence goes awry. As a result, people with chronic wounds often face not only physiological difficulties but emotional ones as well. The study of body image and its damage as a result of a chronic wound fits well with Selder's transition theory. This article describes interviews with seven patients with chronic wounds. The themes that emerged from those interviews were compared with Selder's theory to describe patients' experience with chronic wounds as a transition process that can be identified and better understood by healthcare providers.
Transitional clerkship: an experiential course based on workplace learning theory.
Chittenden, Eva H; Henry, Duncan; Saxena, Varun; Loeser, Helen; O'Sullivan, Patricia S
2009-07-01
Starting clerkships is anxiety provoking for medical students. To ease the transition from preclerkship to clerkship curricula, schools offer classroom-based courses which may not be the best model for preparing learners. Drawing from workplace learning theory, the authors developed a seven-day transitional clerkship (TC) in 2007 at the University of California, San Francisco School of Medicine in which students spent half of the course in the hospital, learning routines and logistics of the wards along with their roles and responsibilities as members of ward teams. Twice, they admitted and followed a patient into the next day as part of a shadow team that had no patient-care responsibilities. Dedicated preceptors gave feedback on oral presentations and patient write-ups. Satisfaction with the TC was higher than with the previous year's classroom-based course. TC students felt clearer about their roles and more confident in their abilities as third-year students compared with previous students. TC students continued to rate the transitional course highly after their first clinical rotation. Preceptors were enthusiastic about the course and expressed willingness to commit to future TC preceptorships. The transitional course models an approach to translating workplace learning theory into practice and demonstrates improved satisfaction, better understanding of roles, and increased confidence among new third-year students.
Benner, Aprile D; Boyle, Alaina E; Bakhtiari, Farin
2017-10-01
The transition to high school is disruptive for many adolescents, yet little is known about the supportive relational processes that might attenuate the challenges students face as they move from middle to high school, particularly for students from more diverse backgrounds. Identifying potential buffers that protect youth across this critical educational transition is important for informing more effective support services for youth. In this study, we investigated how personal characteristics (gender, nativity, parent education level) and changes in support from family, friends, and school influenced changes in socioemotional adjustment and academic outcomes across the transition from middle to high school. The data were drawn from 252 students (50% females, 85% Latina/o). The results revealed declines in students' grades and increases in depressive symptoms and feelings of loneliness across the high school transition, with key variation by student nativity and gender. Additionally, stable/increasing friend support and school belonging were both linked to less socioemotional disruptions as students moved from middle to high school. Increasing/stable school belonging was also linked to increases in school engagement across the high school transition. These findings suggest that when high school transitions disrupt supportive relationships with important others in adolescents' lives, adolescents' socioemotional well-being and, to a lesser extent, their academic engagement are also compromised. Thus, in designing transition support activities, particularly for schools serving more low-income and race/ethnic minority youth, such efforts should strive to acclimate new high school students by providing inclusive, caring environments and positive connections with educators and peers.
New Theories on Boundary Layer Transition and Turbulence Formation
Directory of Open Access Journals (Sweden)
Chaoqun Liu
2012-01-01
Full Text Available This paper is a short review of our recent DNS work on physics of late boundary layer transition and turbulence. Based on our DNS observation, we propose a new theory on boundary layer transition, which has five steps, that is, receptivity, linear instability, large vortex structure formation, small length scale generation, loss of symmetry and randomization to turbulence. For turbulence generation and sustenance, the classical theory, described with Richardson's energy cascade and Kolmogorov length scale, is not observed by our DNS. We proposed a new theory on turbulence generation that all small length scales are generated by “shear layer instability” through multiple level ejections and sweeps and consequent multiple level positive and negative spikes, but not by “vortex breakdown.” We believe “shear layer instability” is the “mother of turbulence.” The energy transferring from large vortices to small vortices is carried out by multiple level sweeps, but does not follow Kolmogorov's theory that large vortices pass energy to small ones through vortex stretch and breakdown. The loss of symmetry starts from the second level ring cycle in the middle of the flow field and spreads to the bottom of the boundary layer and then the whole flow field.
Density Functional Theory for Phase-Ordering Transitions
Energy Technology Data Exchange (ETDEWEB)
Wu, Jianzhong [Univ. of California, Riverside, CA (United States)
2016-03-30
Colloids display astonishing structural and dynamic properties that can be dramatically altered by modest changes in the solution condition or an external field. This complex behavior stems from a subtle balance of colloidal forces and intriguing mesoscopic and macroscopic phase transitions that are sensitive to the processing conditions and the dispersing environment. Whereas the knowledge on the microscopic structure and phase behavior of colloidal systems at equilibrium is now well-advanced, quantitative predictions of the dynamic properties and the kinetics of phase-ordering transitions in colloids are not always realized. Many important mesoscopic and off-equilibrium colloidal states remain poorly understood. The proposed research aims to develop a new, unifying approach to describe colloidal dynamics and the kinetics of phase-ordering transitions based on accomplishments from previous work for the equilibrium properties of both uniform and inhomogeneous systems and on novel concepts from the state-of-the-art dynamic density functional theory. In addition to theoretical developments, computational research is designed to address a number of fundamental questions on phase-ordering transitions in colloids, in particular those pertinent to a competition of the dynamic pathways leading to various mesoscopic structures, off-equilibrium states, and crystalline phases. By providing a generic theoretical framework to describe equilibrium, metastable as well as non-ergodic phase transitions concurrent with the colloidal self-assembly processes, accomplishments from this work will have major impacts on both fundamental research and technological applications.
A Theory of Exoplanet Transits with Light Scattering
Energy Technology Data Exchange (ETDEWEB)
Robinson, Tyler D., E-mail: tydrobin@ucsc.edu [Department of Astronomy and Astrophysics, University of California, Santa Cruz, CA 95064 (United States)
2017-02-20
Exoplanet transit spectroscopy enables the characterization of distant worlds, and will yield key results for NASA's James Webb Space Telescope . However, transit spectra models are often simplified, omitting potentially important processes like refraction and multiple scattering. While the former process has seen recent development, the effects of light multiple scattering on exoplanet transit spectra have received little attention. Here, we develop a detailed theory of exoplanet transit spectroscopy that extends to the full refracting and multiple scattering case. We explore the importance of scattering for planet-wide cloud layers, where the relevant parameters are the slant scattering optical depth, the scattering asymmetry parameter, and the angular size of the host star. The latter determines the size of the “target” for a photon that is back-mapped from an observer. We provide results that straightforwardly indicate the potential importance of multiple scattering for transit spectra. When the orbital distance is smaller than 10–20 times the stellar radius, multiple scattering effects for aerosols with asymmetry parameters larger than 0.8–0.9 can become significant. We provide examples of the impacts of cloud/haze multiple scattering on transit spectra of a hot Jupiter-like exoplanet. For cases with a forward and conservatively scattering cloud/haze, differences due to multiple scattering effects can exceed 200 ppm, but shrink to zero at wavelength ranges corresponding to strong gas absorption or when the slant optical depth of the cloud exceeds several tens. We conclude with a discussion of types of aerosols for which multiple scattering in transit spectra may be important.
Cepeda-Pizarro, Jorge; Vega, Solange; Vásquez, Hernán; Elgueta, Mario; Pizarro-Araya, Jaime
2007-01-01
Under certain environmental conditions, several species of grasshoppers inhabiting rangeland areas (e.g., inter-valleys) of the Chilean transitional desert can irrupt demographically. One of them is Elasmoderus wagenknechti (Liebermann), an endemic species. We studied two outbreaks occurred in 1996 and 1999. The objectives of the research were to (i) estimate some demographic parameters associated with the aforementioned events, and (ii) compare between them the population parameters. The parameters we studied were density (ind/m(2)), sexual proportion, female fertility (i.e., eggs/female), and the relationship eggs/female versus female size. Density (ind/m(2)) ranged from 0.2 to 0.4 in 1996 and from 0.5 to 0.6 in 1999. ANOVA-tests registered differences in density among study sites and between years. In some of the study sites, females were more abundant than males (e.g., Lomas del Sauce). Females fertility ranged from 27 to 39 eggs per female, with significant differences among sites in 1996 but not in 1999. For females of 30-50 mm body size, a linear relationship was detected between egg number/female and body size. It is concluded that the E. wagenknechti outbreaks are site-specific in the study area and that the demographic parameters examined show a high variability among sites and between events.
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Bovolenta TM
2017-01-01
Full Text Available Tânia M Bovolenta, Andre C Felicio R. Neurology Program, Hospital Israelita Albert Einstein, São Paulo, Brazil Abstract: Brazil is currently experiencing a significant demographic transition characterized by a decrease in fertility rates and an exponential increase in the number of elderly citizens, which presents a special challenge for the health care professionals. More than other portions of the population, the elderly are most commonly affected by chronic diseases such as Parkinson’s disease. Policymakers contend that Brazil is reasonably well-prepared regarding elderly health care, with policies that aim to ensure the quality of life and the well-being of this portion of the population. However, what happens in practice falls short of what the Brazilian Constitution sets forth. Specifically, there is a clear contradiction between what the law recognizes as being a citizen’s rights and the implementation of guidelines. Because health financing in Brazil remains relatively low, the civil society tries to fill in the gaps as much as possible in the treatment of elderly patients suffering from chronic diseases such as Parkinson’s disease. In this review, we outline the current legislation in Brazil regarding the elderly and in particular, patients with Parkinson’s disease, in the context of a rapidly aging population. Keywords: Parkinson’s disease, demographic transition, public health, health assistance financing
Quantum field theory and phase transitions: universality and renormalization group
International Nuclear Information System (INIS)
Zinn-Justin, J.
2003-08-01
In the quantum field theory the problem of infinite values has been solved empirically through a method called renormalization, this method is satisfying only in the framework of renormalization group. It is in the domain of statistical physics and continuous phase transitions that these issues are the easiest to discuss. Within the framework of a course in theoretical physics the author introduces the notions of continuous limits and universality in stochastic systems operating with a high number of freedom degrees. It is shown that quasi-Gaussian and mean field approximation are unable to describe phase transitions in a satisfying manner. A new concept is required: it is the notion of renormalization group whose fixed points allow us to understand universality beyond mean field. The renormalization group implies the idea that long distance correlations near the transition temperature might be described by a statistical field theory that is a quantum field in imaginary time. Various forms of renormalization group equations are presented and solved in particular boundary limits, namely for fields with high numbers of components near the dimensions 4 and 2. The particular case of exact renormalization group is also introduced. (A.C.)
A multistep general theory of transition to addiction.
Piazza, Pier Vincenzo; Deroche-Gamonet, Véronique
2013-10-01
Several theories propose alternative explanations for drug addiction. We propose a general theory of transition to addiction that synthesizes knowledge generated in the field of addiction into a unitary explanatory frame. Transition to addiction results from a sequential three-step interaction between: (1) individual vulnerability; (2) degree/amount of drug exposure. The first step, sporadic recreational drug use is a learning process mediated by overactivation of neurobiological substrates of natural rewards that allows most individuals to perceive drugs as highly rewarding stimuli. The second, intensified, sustained, escalated drug use occurs in some vulnerable individuals who have a hyperactive dopaminergic system and impaired prefrontal cortex function. Sustained and prolonged drug use induces incentive sensitization and an allostatic state that makes drugs strongly wanted and needed. Habit formation can also contribute to stabilizing sustained drug use. The last step, loss of control of drug intake and full addiction, is due to a second vulnerable phenotype. This loss-of-control-prone phenotype is triggered by long-term drug exposure and characterized by long-lasting loss of synaptic plasticity in reward areas in the brain that induce a form of behavioral crystallization resulting in loss of control of drug intake. Because of behavioral crystallization, drugs are now not only wanted and needed but also pathologically mourned when absent. This general theory demonstrates that drug addiction is a true psychiatric disease caused by a three-step interaction between vulnerable individuals and amount/duration of drug exposure.
Self-consistent theory of normal-to-superconducting transition
International Nuclear Information System (INIS)
Radzihovsky, L.; Chicago Univ., IL
1995-01-01
I study the normal-to-superconducting (NS) transition within the Ginzburg-Landau (GL) model, taking into account the fluctuations in the m-component complex order parameter ψ α and the vector potential A in the arbitrary dimension d, for any m. I find that the transition is of second order and that the previous conclusion of the fluctuation-driven first-order transition is a possible artifact of the breakdown of the ε-expansion and the inaccuracy of the 1/m-expansion for physical values ε = 1, m 1. I compute the anomalous η(d, m) exponent at the NS transition, and find η(3, 1) ∼ -0.38. In the m → ∞ limit, η(d, m) becomes exact and agrees with the 1/m-expansion. Near d = 4 the theory is also in good agreement with the perturbative ε-expansion results for m > 183 and provides a sensible interpolation formula for arbitrary d and m. (orig.)
Mean-field theory for a ferroelectric transition
International Nuclear Information System (INIS)
Dobry, A.; Greco, A.; Stachiotti, M.
1990-01-01
For the treatment of anharmonic models of solids presenting structural transitions, a commonly used approximation is that of self-consistent phonons. Rather than the usual site decoupling, this mean-field theory is based on decoupling of modes in reciprocal space. A self-consistent phonon approximation for the non-linear polarizability model is developed in this work. The model describes the dynamical properties of ferroelectric materials. Phase diagrams as a function of relevant model parameters are presented. An analysis is made of critical behaviour and it is shown that the approximation leads to the same anomalies found in other models. (Author). 9 refs., 3 figs
QED theory of multiphoton transitions in atoms and ions
Zalialiutdinov, Timur A.; Solovyev, Dmitry A.; Labzowsky, Leonti N.; Plunien, Günter
2018-03-01
This review surveys the quantum theory of electromagnetic radiation for atomic systems. In particular, a review of current theoretical studies of multiphoton processes in one and two-electron atoms and highly charged ions is provided. Grounded on the quantum electrodynamics description the multiphoton transitions in presence of cascades, spin-statistic behaviour of equivalent photons and influence of external electric fields on multiphoton in atoms and anti-atoms are discussed. Finally, the nonresonant corrections which define the validity of the concept of the excited state energy levels are introduced.
Directory of Open Access Journals (Sweden)
Jianghua Liu
Full Text Available Radical declines in fertility and postponement of first reproduction during the recent human demographic transitions have posed a challenge to interpreting human behaviour in evolutionary terms. This challenge has stemmed from insufficient evolutionary insight into individual reproductive decision-making and the rarity of datasets recording individual long-term reproductive success throughout the transitions. We use such data from about 2,000 Finnish mothers (first births: 1880s to 1970s to show that changes in the maternal risk of breeding failure (no offspring raised to adulthood underlay shifts in both fertility and first reproduction. With steady improvements in offspring survival, the expected fertility required to satisfy a low risk of breeding failure became lower and observed maternal fertility subsequently declined through an earlier age at last reproduction. Postponement of the age at first reproduction began when this risk approximated zero-even for mothers starting reproduction late. Interestingly, despite vastly differing fertility rates at different stages of the transitions, the number of offspring successfully raised to breeding per mother remained relatively constant over the period. Our results stress the importance of assessing the long-term success of reproductive strategies by including measures of offspring quality and suggest that avoidance of breeding failure may explain several key features of recent life-history shifts in industrialized societies.
Liu, Jianghua; Rotkirch, Anna; Lummaa, Virpi
2012-01-01
Radical declines in fertility and postponement of first reproduction during the recent human demographic transitions have posed a challenge to interpreting human behaviour in evolutionary terms. This challenge has stemmed from insufficient evolutionary insight into individual reproductive decision-making and the rarity of datasets recording individual long-term reproductive success throughout the transitions. We use such data from about 2,000 Finnish mothers (first births: 1880s to 1970s) to show that changes in the maternal risk of breeding failure (no offspring raised to adulthood) underlay shifts in both fertility and first reproduction. With steady improvements in offspring survival, the expected fertility required to satisfy a low risk of breeding failure became lower and observed maternal fertility subsequently declined through an earlier age at last reproduction. Postponement of the age at first reproduction began when this risk approximated zero–even for mothers starting reproduction late. Interestingly, despite vastly differing fertility rates at different stages of the transitions, the number of offspring successfully raised to breeding per mother remained relatively constant over the period. Our results stress the importance of assessing the long-term success of reproductive strategies by including measures of offspring quality and suggest that avoidance of breeding failure may explain several key features of recent life-history shifts in industrialized societies. PMID:22529952
Men's passage to fatherhood: an analysis of the contemporary relevance of transition theory
Draper, Janet
2003-01-01
This paper presents a theoretical analysis of men's experiences of pregnancy, birth and early fatherhood. It does so using a framework of ritual transition theory and argues that despite its earlier structural-functionalist roots, transition theory remains a valuable framework, illuminating contemporary transitions across the life course. The paper discusses the historical development of transition or ritual theory and, drawing upon data generated during longitudinal ethnographic interviews w...
Childhood obesity in transition zones: an analysis using structuration theory.
Chan, Christine; Deave, Toity; Greenhalgh, Trisha
2010-07-01
Childhood obesity is particularly prevalent in areas that have seen rapid economic growth, urbanisation, cultural transition, and commodification of food systems. Structuration theory may illuminate the interaction between population and individual-level causes of obesity. We conducted in-depth ethnographies of six overweight/obese and four non-overweight preschool children in Hong Kong, each followed for 12-18 months. Analysis was informed by Stones' strong structuration theory. Risk factors played out differently for different children as social structures were enacted at the level of family and preschool. The network of caregiving roles and relationships around the overweight/obese child was typically weak and disjointed, and the primary caregiver appeared confused by mixed messages about what is normal, expected and legitimate behaviour. In particular, external social structures created pressure to shift childcare routines from the logic of nurturing to the logic of consumption. Our findings suggest that threats to what Giddens called ontological security in the primary caregiver may underpin the poor parenting, family stress and weak mealtime routines that mediate the relationship between an obesogenic environment and the development of obesity in a particular child. This preliminary study offers a potentially transferable approach for studying emerging epidemics of diseases of modernity in transition societies.
Jain, Amber; Herman, Michael F; Ouyang, Wenjun; Subotnik, Joseph E
2015-10-07
We provide an in-depth investigation of transmission coefficients as computed using the augmented-fewest switches surface hopping algorithm in the low energy regime. Empirically, microscopic reversibility is shown to hold approximately. Furthermore, we show that, in some circumstances, including decoherence on top of surface hopping calculations can help recover (as opposed to destroy) oscillations in the transmission coefficient as a function of energy; these oscillations can be studied analytically with semiclassical scattering theory. Finally, in the spirit of transition state theory, we also show that transmission coefficients can be calculated rather accurately starting from the curve crossing point and running trajectories forwards and backwards.
K-theory and phase transitions at high energies
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T. V. Obikhod
2016-06-01
Full Text Available The duality between E8xE8 heteritic string on manifold K3xT2 and Type IIA string compactified on a Calabi-Yau manifold induces a correspondence between vector bundles on K3xT2 and Calabi-Yau manifolds. Vector bundles over compact base space K3xT2 form the set of isomorphism classes, which is a semi-ring under the operation of Whitney sum and tensor product. The construction of semi-ring V ect X of isomorphism classes of complex vector bundles over X leads to the ring KX = K(V ect X, called Grothendieck group. As K3 has no isometries and no non-trivial one-cycles, so vector bundle winding modes arise from the T2 compactification. Since we have focused on supergravity in d = 11, there exist solutions in d = 10 for which space-time is Minkowski space and extra dimensions are K3xT2. The complete set of soliton solutions of supergravity theory is characterized by RR charges, identified by K-theory. Toric presentation of Calabi-Yau through Batyrev's toric approximation enables us to connect transitions between Calabi-Yau manifolds, classified by enhanced symmetry group, with K-theory classification.
Disease introduction is associated with a phase transition in bighorn sheep demographics
Manlove, Kezia; Cassirer, E. Frances; Cross, Paul C.; Plowright, Raina K.; Hudson, Peter J.
2016-01-01
Ecological theory suggests that pathogens are capable of regulating or limiting host population dynamics, and this relationship has been empirically established in several settings. However, although studies of childhood diseases were integral to the development of disease ecology, few studies show population limitation by a disease affecting juveniles. Here, we present empirical evidence that disease in lambs constrains population growth in bighorn sheep (Ovis canadensis) based on 45 years of population-level and 18 years of individual-level monitoring across 12 populations. While populations generally increased (λ = 1.11) prior to disease introduction, most of these same populations experienced an abrupt change in trajectory at the time of disease invasion, usually followed by stagnant-to-declining growth rates (λ = 0.98) over the next 20 years. Disease-induced juvenile mortality imposed strong constraints on population growth that were not observed prior to disease introduction, even as adult survival returned to pre-invasion levels. Simulations suggested that models including persistent disease-induced mortality in juveniles qualitatively matched observed population trajectories, whereas models that only incorporated all-age disease events did not. We use these results to argue that pathogen persistence may pose a lasting, but under-recognized, threat to host populations, particularly in cases where clinical disease manifests primarily in juveniles.
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Derek A T Cummings
2009-09-01
that the critical vaccination fraction has not changed significantly, declining from an average of 85% to 80%. Clinical guidelines should consider the impact of continued increases in the age of dengue cases in Thailand. Countries in the region lagging behind Thailand in the demographic transition may experience the same increase as their population ages. The impact of demographic changes on the force of infection has been hypothesized for other diseases, but, to our knowledge, this is the first observation of this phenomenon. Please see later in the article for the Editors' Summary.
Navarro, Jordana N; Jasinski, Jana L
2015-01-01
This article presents an analysis of the relationship between online sexual offenders' demographic background and characteristics indicative of motivation and offense type. Specifically, we investigate whether these characteristics can distinguish different online sexual offender groups from one another as well as inform routine activity theorists on what potentially motivates perpetrators. Using multinomial logistic regression, this study found that online sexual offenders' demographic backgrounds and characteristics indicative of motivation do vary by offense types. Two important implications of this study are that the term "online sexual offender" encompasses different types of offenders, including some who do not align with mainstream media's characterization of "predators," and that the potential offender within routine activity theory can be the focus of empirical investigation rather than taken as a given in research.
Density functional theory studies of transition metal nanoparticles in catalysis
DEFF Research Database (Denmark)
Greeley, Jeffrey Philip; Rankin, Rees; Zeng, Zhenhua
2013-01-01
Periodic Density Functional Theory calculations are capable of providing powerful insights into the structural, energetics, and electronic phenomena that underlie heterogeneous catalysis on transition metal nanoparticles. Such calculations are now routinely applied to single crystal metal surfaces...... and to subnanometer metal clusters. Descriptions of catalysis on truly nanosized structures, however, are generally not as well developed. In this talk, I will illustrate different approaches to analyzing nanocatalytic phenomena with DFT calculations. I will describe case studies from heterogeneous catalysis...... and electrocatalysis, in which single crystal models are combined with Wulff construction-based ideas to produce descriptions of average nanocatalyst behavior. Then, I will proceed to describe explicitly DFT-based descriptions of catalysis on truly nanosized particles (
Theory of the pairbreaking superconductor-metal transition in nanowires
International Nuclear Information System (INIS)
Del Maestro, Adrian; Rosenow, Bernd; Sachdev, Subir
2009-01-01
We present a detailed description of a zero temperature phase transition between superconducting and diffusive metallic states in very thin wires due to a Cooper pair breaking mechanism. The dissipative critical theory contains current reducing fluctuations in the guise of both quantum and thermally activated phase slips. A full cross-over phase diagram is computed via an expansion in the inverse number of complex components of the superconducting order parameter (one in the physical case). The fluctuation corrections to the electrical (σ) and thermal (κ) conductivities are determined, and we find that σ has a non-monotonic temperature dependence in the metallic phase which may be consistent with recent experimental results on ultra-narrow wires. In the quantum critical regime, the ratio of the thermal to electrical conductivity displays a linear temperature dependence and thus the Wiedemann-Franz law is obeyed, with a new universal experimentally verifiable Lorenz number
Random walk theory and exchange rate dynamics in transition economies
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Gradojević Nikola
2010-01-01
Full Text Available This paper investigates the validity of the random walk theory in the Euro-Serbian dinar exchange rate market. We apply Andrew Lo and Archie MacKinlay's (1988 conventional variance ratio test and Jonathan Wright's (2000 non-parametric ranks and signs based variance ratio tests to the daily Euro/Serbian dinar exchange rate returns using the data from January 2005 - December 2008. Both types of variance ratio tests overwhelmingly reject the random walk hypothesis over the data span. To assess the robustness of our findings, we examine the forecasting performance of a non-linear, nonparametric model in the spirit of Francis Diebold and James Nason (1990 and find that it is able to significantly improve upon the random walk model, thus confirming the existence of foreign exchange market imperfections in a small transition economy such as Serbia. In the last part of the paper, we conduct a comparative study on how our results relate to those of other transition economies in the region.
Transition-state theory predicts clogging at the microscale
Laar, T. Van De; Klooster, S. Ten; Schroën, K.; Sprakel, J.
2016-06-01
Clogging is one of the main failure mechanisms encountered in industrial processes such as membrane filtration. Our understanding of the factors that govern the build-up of fouling layers and the emergence of clogs is largely incomplete, so that prevention of clogging remains an immense and costly challenge. In this paper we use a microfluidic model combined with quantitative real-time imaging to explore the influence of pore geometry and particle interactions on suspension clogging in constrictions, two crucial factors which remain relatively unexplored. We find a distinct dependence of the clogging rate on the entrance angle to a membrane pore which we explain quantitatively by deriving a model, based on transition-state theory, which describes the effect of viscous forces on the rate with which particles accumulate at the channel walls. With the same model we can also predict the effect of the particle interaction potential on the clogging rate. In both cases we find excellent agreement between our experimental data and theory. A better understanding of these clogging mechanisms and the influence of design parameters could form a stepping stone to delay or prevent clogging by rational membrane design.
Marcante, Silvia; Winkler, Eckart; Erschbamer, Brigitta
2009-05-01
Understanding processes and mechanisms governing changes in plant species along primary successions has been of major importance in ecology. However, to date hardly any studies have focused on the complete life cycle of species along a successional gradient, comparing pioneer, early and late-successional species. In this study it is hypothesized that pioneer species should initially have a population growth rate, lambda, greater than one with high fecundity rates, and declining growth rates when they are replaced by late-successional species. Populations of late-successional species should also start, at the mid-successional stage (when pioneer species are declining), with growth rates greater than one and arrive at rates equal to one at the late successional stage, mainly due to higher survival rates that allow these species to persist for a long time. The demography of pioneer- (Saxifraga aizoides), early (Artemisia genipi) and late-successional species (Anthyllis vulneraria ssp. alpicola) was investigated together with that of a ubiquitous species (Poa alpina) along the Rotmoos glacier foreland (2300-2400 m a.s.l., Central Alps, Austria) over 3 years. A matrix modelling approach was used to compare the main demographic parameters. Elasticity values were plotted in a demographic triangle using fecundity, individual growth and survival as vital rates contributing to the population growth rates. The results largely confirmed the predictions for population growth rates during succession. However, high survival rates of larger adults characterized all species, regardless of where they were growing along the succession. At the pioneer site, high mortality rates of seedlings, plantlets and young individuals were recorded. Fecundity was found to be of minor relevance everywhere, but it was nevertheless sufficient to increase or maintain the population sizes. Demographically, all the species over all sites behaved like late-successional or climax species in secondary
Assessment of Prevalence of Persons with Down Syndrome: A Theory-Based Demographic Model
de Graaf, Gert; Vis, Jeroen C.; Haveman, Meindert; van Hove, Geert; de Graaf, Erik A. B.; Tijssen, Jan G. P.; Mulder, Barbara J. M.
2011-01-01
Background: The Netherlands are lacking reliable empirical data in relation to the development of birth and population prevalence of Down syndrome. For the UK and Ireland there are more historical empirical data available. A theory-based model is developed for predicting Down syndrome prevalence in the Netherlands from the 1950s onwards. It is…
Zupančič, Maja; Komidar, Luka; Levpušček, Melita Puklek
2014-12-01
The study investigated associations of Slovene emerging adults' age, gender, living situation, romantic relationship, and employment status with aspects of individuation in relation to mother and father. Controlling for demographic variables and transitional markers of adulthood, we further explored the contribution of individuation measures to individuals' perceptions of achieved criteria for adulthood and life satisfaction. The participants provided self-reports on the Individuation Test for Emerging Adults, the Satisfaction With Life Scale, and the list of Achieved Criteria for Adulthood. Age and living out of parental home were positively associated with self-reliance in relation to both parents, whereas female gender was related to higher levels of connectedness and seeking parental support. Along with age and involvement in a romantic relationship, connectedness and self-reliance predicted adulthood criteria attainment and life satisfaction. The results support the models of individuation that emphasize growing autonomy and retaining connectedness to parents as pathways towards personal adjustments. Copyright © 2014 The Foundation for Professionals in Services for Adolescents. Published by Elsevier Ltd. All rights reserved.
A Complete Approximation Theory for Weighted Transition Systems
DEFF Research Database (Denmark)
Hansen, Mikkel; Larsen, Kim Guldstrand; Mardare, Radu Iulian
2016-01-01
We propose a way of reasoning about minimal and maximal values of the weights of transitions in a weighted transition system (WTS). This perspective induces a notion of bisimulation that is coarser than the classic bisimulation: it relates states that exhibit transitions to bisimulation classes...... the image-finiteness restriction, a fact that makes this development general and robust....
Theory of optical transitions in conjugated polymers. I. Ideal systems.
Barford, William; Marcus, Max
2014-10-28
We describe a theory of linear optical transitions in conjugated polymers. The theory is based on three assumptions. The first is that the low-lying excited states of conjugated polymers are Frenkel excitons coupled to local normal modes, described by the Frenkel-Holstein model. Second, we assume that the relevant parameter regime is ℏω ≪ J, i.e., the adiabatic regime, and thus the Born-Oppenheimer factorization of the electronic and nuclear degrees of freedom is generally applicable. Finally, we assume that the Condon approximation is valid, i.e., the exciton-polaron wavefunction is essentially independent of the normal modes. Using these assumptions we derive an expression for an effective Huang-Rhys parameter for a chain (or chromophore) of N monomers, given by S(N) = S(1)/IPR, where S(1) is the Huang-Rhys parameter for an isolated monomer. IPR is the inverse participation ratio, defined by IPR = (∑(n)|Ψ(n)|(4))(-1), where Ψ(n) is the exciton center-of-mass wavefunction. Since the IPR is proportional to the spread of the exciton center-of-mass wavefunction, this is a key result, as it shows that S(N) decreases with chain length. As in molecules, in a polymer S(N) has two interpretations. First, ℏωS(N) is the relaxation energy of an excited state caused by its coupling to the normal modes. Second, S(N) appears in the definition of an effective Franck-Condon factor, F(0v)(N) = S(N)(v)exp ( - S(N))/v! for the vth vibronic manifold. We show that the 0 - 0 and 0 - 1 optical intensities are proportional to F00(N) and F01(N), respectively, and thus the ratio of the 0 - 1 to 0 - 0 absorption and emission intensities are proportional to S(N). These analytical results are checked by extensive DMRG calculations and found to be generally valid, particularly for emission. However, for large chain lengths higher-lying quasimomentum exciton states become degenerate with the lowest vibrational excitation of the lowest exciton state. When this happens there is
Joly, Elizabeth
2016-06-01
To present a discussion of a theoretical perspective developed through integrating Meleis' Transition Theory and Bronfenbrenner's Bioecological Theory of Human Development to inform nursing and advanced nursing practice supporting the transition to adulthood for young people with medical complexity. Theoretical perspectives to inform nursing practice in supporting successful transition are limited, yet nurses frequently encounter young people with medical complexity during the transition to adulthood. Discussion paper. A literature search of CINAHL and Medline was conducted in 2014 and included articles from 2003-2014; informal discussions with families; the author's experiences in a transition program. The integrated theoretical perspective described in this paper can inform nurses and advanced practice nurses on contextual influences, program and intervention development across spheres of influence and outcomes for the transition to adulthood for young people with medical complexity. Young people and their families require effective reciprocal interactions with individuals and services across sectors to successfully transition to adulthood and become situated in the adult world. Intervention must also extend beyond the young person to include providers, services and health and social policy. Nurses can take a leadership role in supporting the transition to adulthood for young people with medical complexity through direct care, case management, education and research. It is integral that nurses holistically consider developmental processes, complexity and contextual conditions that promote positive outcomes during and beyond the transition to adulthood. © 2016 John Wiley & Sons Ltd.
International Nuclear Information System (INIS)
Srivastava, Prem P.
1994-01-01
The Dirac procedure is used to construct the Hamiltonian formulation of the scalar field theory on the light-front. The theory is quantized and the mechanism of the spontaneous symmetry breaking in the front form and the instant form dynamics are compared. The phase transition in (φ 4 )2 theory is also discussed and found to be of the second order. (author). 36 refs
Non-equilibrium random matrix theory. Transition probabilities
Energy Technology Data Exchange (ETDEWEB)
Pedro, Francisco Gil [Univ. Autonoma de Madrid (Spain). Dept. de Fisica Teorica; Westphal, Alexander [Deutsches Elektronen-Synchrotron (DESY), Hamburg (Germany). Gruppe Theorie
2016-06-15
In this letter we present an analytic method for calculating the transition probability between two random Gaussian matrices with given eigenvalue spectra in the context of Dyson Brownian motion. We show that in the Coulomb gas language, in large N limit, memory of the initial state is preserved in the form of a universal linear potential acting on the eigenvalues. We compute the likelihood of any given transition as a function of time, showing that as memory of the initial state is lost, transition probabilities converge to those of the static ensemble.
Non-equilibrium random matrix theory. Transition probabilities
International Nuclear Information System (INIS)
Pedro, Francisco Gil; Westphal, Alexander
2016-06-01
In this letter we present an analytic method for calculating the transition probability between two random Gaussian matrices with given eigenvalue spectra in the context of Dyson Brownian motion. We show that in the Coulomb gas language, in large N limit, memory of the initial state is preserved in the form of a universal linear potential acting on the eigenvalues. We compute the likelihood of any given transition as a function of time, showing that as memory of the initial state is lost, transition probabilities converge to those of the static ensemble.
Theory of Valence Transitions in Ytterbium and Europium Intermetallics
International Nuclear Information System (INIS)
Zlatic, V.; Freericks, J.K.
2001-01-01
The exact solution of the multi-component Falicov-Kimball model in infinite-dimensions is presented and used to discuss a new fixed point of valence fluctuating intermetallics with Yb and Eu ions. In these compounds, temperature, external magnetic field, pressure, or chemical pressure induce a transition between a metallic state with the f-ions in a mixed-valent (non-magnetic) configuration and a semi-metallic state with the f-ions in an integral-valence (paramagnetic) configuration. The zero-field transition occurs at the temperature T V , while the zero-temperature transition sets in at the critical field H c . We present the thermodynamic and dynamic properties of the model for an arbitrary concentration of d- and f -electrons. For large U, we find a MI transition, triggered by the temperature or field- induced change in the f-occupancy. (author)
Selection Bias in Educational Transition Models: Theory and Empirical Evidence
DEFF Research Database (Denmark)
Holm, Anders; Jæger, Mads
variables. This paper, first, explains theoretically how selection on unobserved variables leads to waning coefficients and, second, illustrates empirically how selection leads to biased estimates of the effect of family background on educational transitions. Our empirical analysis using data from...
Modal Transition Systems as the Basis for Interface Theories and Product Lines
DEFF Research Database (Denmark)
Nyman, Ulrik
and a subset of modal transition systems is proved. The developed interface theory, which can describe liveness properties, is also applied as a behavioral variability theory for product line development. The two last papers of the thesis concern themselves with modal and mixed transition systems. The first....... It also proves PSPACE-hardness for consistency of mixed specifications and establishes a number of reductions between the different decision problems. Keywords: Modeling, Software Product Lines, Embedded Software, Modal Refinement, Labeled Transition Systems, Modal Transition Systems, Mixed Transition......This thesis presents research taking its outset in component-based software development, interface theory and software product lines, as well as modeling formalisms for describing component based software systems and their interfaces. The main part of the thesis consists of five papers. The first...
Assessment of a transitional boundary layer theory at low hypersonic Mach numbers
Shamroth, S. J.; Mcdonald, H.
1972-01-01
An investigation was carried out to assess the accuracy of a transitional boundary layer theory in the low hypersonic Mach number regime. The theory is based upon the simultaneous numerical solution of the boundary layer partial differential equations for the mean motion and an integral form of the turbulence kinetic energy equation which controls the magnitude and development of the Reynolds stress. Comparisions with experimental data show the theory is capable of accurately predicting heat transfer and velocity profiles through the transitional regime and correctly predicts the effects of Mach number and wall cooling on transition Reynolds number. The procedure shows promise of predicting the initiation of transition for given free stream disturbance levels. The effects on transition predictions of the pressure dilitation term and of direct absorption of acoustic energy by the boundary layer were evaluated.
Testing the renormalisation group theory of cooperative transitions at the lambda point of helium
Lipa, J. A.; Li, Q.; Chui, T. C. P.; Marek, D.
1988-01-01
The status of high resolution tests of the renormalization group theory of cooperative phase transitions performed near the lambda point of helium is described. The prospects for performing improved tests in space are discussed.
DEFF Research Database (Denmark)
Mackeprang, Kasper; Kjærgaard, Henrik Grum
2017-01-01
The local mode perturbation theory (LMPT) model was developed to improve the description of hydrogen bonded XH-stretching transitions, where X is typically O or N. We present a modified version of the LMPT model to extend its application from hydrated bimolecular complexes to hydrogen bonded...
International Nuclear Information System (INIS)
Srivastava, P.P.
1993-01-01
The field theory quantized on the light-front is compared with the conventional equal-time quantized theory. The arguments based on the micro causality principle would imply that the light-front field theory may become nonlocal with respect to the longitudinal coordinate even though the corresponding equal-time formulation is local. This is found to be the case for the scalar theory. The conventional instant form theory is sometimes required to be constrained by invoking external physical considerations; the analogous conditions seem to be already built in the theory on the light-front. In spite of the different mechanisms of the spontaneous symmetry breaking in the two forms of dynamics they result in the same physical content. The phase transition in (φ 4 ) 2 theory is also discussed. The symmetric vacuum state for vanishingly small couplings is found to turn into an unstable symmetric one when the coupling is increased and may result in a phase transition of the second order in contrast to the first order transition concluded from the usual variational methods. (author)
Quasi-liquid layer theory based on the bulk first-order phase transition
International Nuclear Information System (INIS)
Ryzhkin, I. A.; Petrenko, V. F.
2009-01-01
The theory of the superionic phase transition (bulk first-order transition) proposed in [1] is used to explain the existence of a quasi-liquid layer at an ice surface below its melting point. An analytical expression is derived for the quasi-liquid layer thickness. Numerical estimates are made and compared with experiment. Distinction is made between the present model and other quasi-liquid layer theories
Theory of magnetic transition metal nanoclusters on surfaces
Energy Technology Data Exchange (ETDEWEB)
Lounis, S.
2007-04-17
This thesis is motivated by the quest for the understanding and the exploration of complex magnetism provided by atomic scale magnetic clusters deposited on surfaces or embedded in the bulk. Use is made of the density functional theory (DFT). Acting within this framework, we have developed and implemented the treatment of non-collinear magnetism into the Juelich version of the full-potential Korringa-Kohn-Rostoker Green Function (KKR-GF) method. Firstly, the method was applied to 3d transition-metal clusters on different ferromagnetic surfaces. Different types of magnetic clusters where selected. In order to investigate magnetic frustration due to competing interactions within the ad-cluster we considered a (001) oriented surface of fcc metals, a topology which usually does not lead to non-collinear magnetism. We tuned the strength of the magnetic coupling between the ad-clusters and the ferromagnetic surface by varying the substrate from the case of Ni(001) with a rather weak hybridization of the Ni d-states with the adatom d-states to the case of Fe{sub 3ML}/Cu(001) with a much stronger hybridization due to the larger extend of the Fe wavefunctions. On Ni(001), the interaction between the Cr- as well as the Mn-dimer adatoms is of antiferromagnetic nature, which is in competition with the interaction with the substrate atoms. After performing total energy calculations we find that for Cr-dimer the ground state is collinear whereas the Mn-dimer prefers the non-collinear configuration as ground state. Bigger clusters are found to be magnetically collinear. These calculations were extended to 3d multimers on Fe{sub 3ML}/Cu(001). All neighboring Cr(Mn) moments in the compact tetramer are antiferromagnetically aligned in-plane, with the directions slightly tilted towards (outwards from) the substrate to gain some exchange interaction energy. The second type of frustration was investigated employing a Ni(111) surface, a surface with a triangular lattice of atoms, were
Unlocking Hospitality Managers Career Transitions through Applying Schein's Career Anchors Theory
McGuire, David; Polla, Giovana; Heidl, Britta
2017-01-01
Purpose: This paper seeks to unlock the career transitions of hospitality managers through applying Schein's career anchors theory. It seeks to understand how Schein's Career Anchors help explain the career transitions of managers in the Scottish hospitality industry. Design/methodology/approach: The paper adopts a non-sequential multi-method…
Chaos Theory as a Model for Life Transitions Counseling: Nonlinear Dynamics and Life's Changes
Bussolari, Cori J.; Goodell, Judith A.
2009-01-01
Chaos theory is presented for counselors working with clients experiencing life transitions. It is proposed as a model that considers disorder, unpredictability, and lack of control as normal parts of transition processes. Nonlinear constructs from physics are adapted for use in counseling. The model provides a method clients can use to…
Estimation and asymptotic theory for transition probabilities in Markov Renewal Multi–state models
Spitoni, C.; Verduijn, M.; Putter, H.
2012-01-01
In this paper we discuss estimation of transition probabilities for semi–Markov multi–state models. Non–parametric and semi–parametric estimators of the transition probabilities for a large class of models (forward going models) are proposed. Large sample theory is derived using the functional
Saudi Deaf Students Post-Secondary Transitioning Experience: A Grounded Theory Study
Almotiri, Abdullah
2017-01-01
Understanding how deaf and hard-of-hearing (DHH) international students transition to post-secondary institutions is important for ensuring their academic and personal success. In this grounded theory study, five Saudi Arabian students who are DHH and enrolled at Gallaudet University were interviewed about their transition experience. Participants…
Transition scattering in electrodynamics and general relativity theory
Energy Technology Data Exchange (ETDEWEB)
Ginzburg, V L; Tsytovich, V N [AN SSSR, Moscow. Fizicheskij Inst.
1975-01-01
The question of transition scattering is discussed, i.e., the production of an electromagnetic wave when a permittivity wave or a gravitational wave fall upon the region with a static electromagnetic field (the field of charge, of an electric or magnetic dipole, and so on).
Deconfinement phase transition and finite-size scaling in SU(2) lattice gauge theory
International Nuclear Information System (INIS)
Mogilevskij, O.A.
1988-01-01
Calculation technique for deconfinement phase transition parameters based on application of finite-size scaling theory is suggested. The essence of the technique lies in plotting of universal scaling function on the basis of numerical data obtained at different-size final lattices and discrimination of phase transition parameters for infinite lattice system. Finite-size scaling technique was developed as applied to spin system theory. β critical index for Polyakov loop and SU(2) deconfinement temperature of lattice gauge theory are calculated on the basis of finite-size scaling technique. The obtained value agrees with critical index of magnetization in Ising three-dimensional model
Systematic expansion in the order parameter for replica theory of the dynamical glass transition.
Jacquin, Hugo; Zamponi, Francesco
2013-03-28
It has been shown recently that predictions from mode-coupling theory for the glass transition of hard-spheres become increasingly bad when dimensionality increases, whereas replica theory predicts a correct scaling. Nevertheless if one focuses on the regime around the dynamical transition in three dimensions, mode-coupling results are far more convincing than replica theory predictions. It seems thus necessary to reconcile the two theoretic approaches in order to obtain a theory that interpolates between low-dimensional, mode-coupling results, and "mean-field" results from replica theory. Even though quantitative results for the dynamical transition issued from replica theory are not accurate in low dimensions, two different approximation schemes--small cage expansion and replicated hyper-netted-chain (RHNC)--provide the correct qualitative picture for the transition, namely, a discontinuous jump of a static order parameter from zero to a finite value. The purpose of this work is to develop a systematic expansion around the RHNC result in powers of the static order parameter, and to calculate the first correction in this expansion. Interestingly, this correction involves the static three-body correlations of the liquid. More importantly, we separately demonstrate that higher order terms in the expansion are quantitatively relevant at the transition, and that the usual mode-coupling kernel, involving two-body direct correlation functions of the liquid, cannot be recovered from static computations.
Polymorphic phase transitions: Macroscopic theory and molecular simulation.
Anwar, Jamshed; Zahn, Dirk
2017-08-01
Transformations in the solid state are of considerable interest, both for fundamental reasons and because they underpin important technological applications. The interest spans a wide spectrum of disciplines and application domains. For pharmaceuticals, a common issue is unexpected polymorphic transformation of the drug or excipient during processing or on storage, which can result in product failure. A more ambitious goal is that of exploiting the advantages of metastable polymorphs (e.g. higher solubility and dissolution rate) while ensuring their stability with respect to solid state transformation. To address these issues and to advance technology, there is an urgent need for significant insights that can only come from a detailed molecular level understanding of the involved processes. Whilst experimental approaches at best yield time- and space-averaged structural information, molecular simulation offers unprecedented, time-resolved molecular-level resolution of the processes taking place. This review aims to provide a comprehensive and critical account of state-of-the-art methods for modelling polymorph stability and transitions between solid phases. This is flanked by revisiting the associated macroscopic theoretical framework for phase transitions, including their classification, proposed molecular mechanisms, and kinetics. The simulation methods are presented in tutorial form, focusing on their application to phase transition phenomena. We describe molecular simulation studies for crystal structure prediction and polymorph screening, phase coexistence and phase diagrams, simulations of crystal-crystal transitions of various types (displacive/martensitic, reconstructive and diffusive), effects of defects, and phase stability and transitions at the nanoscale. Our selection of literature is intended to illustrate significant insights, concepts and understanding, as well as the current scope of using molecular simulations for understanding polymorphic
Statistical theory of L-H transition in tokamaks
Energy Technology Data Exchange (ETDEWEB)
Itoh, S.-I. [Kyushu Univ., Research Institute for Applied Mechanics, Kasuga, Fukuoka (Japan); Itoh, K.; Toda, S. [National Inst. for Fusion Science, Toki, Gifu (Japan)
2003-01-01
A statistical model for the bifurcation of the radial electric field E{sub r} is developed in view of describing L-H transitions of tokamak plasmas. Noise in micro fluctuations is shown to lead to random changes of E{sub r}, if a deterministic approach allows for more than one solution. The probability density function for and the ensemble average of E{sub r} are obtained. The L-to-H and the H-to-L transition probabilities are calculated, and the effective phase limit is derived. Due to the suppression of turbulence by shear in E{sub r}, the limit deviates from Maxwell's rule. The ensemble average of heat flux as well as that of E{sub r} do not show a hysteresis in contrast to the deterministic model. Experimental condition for observing the hysteresis is also addressed. (author)
Statistical theory of L-H transition in tokamaks
International Nuclear Information System (INIS)
Itoh, S.-I.; Itoh, K.; Toda, S.
2003-01-01
A statistical model for the bifurcation of the radial electric field E r is developed in view of describing L-H transitions of tokamak plasmas. Noise in micro fluctuations is shown to lead to random changes of E r , if a deterministic approach allows for more than one solution. The probability density function for and the ensemble average of E r are obtained. The L-to-H and the H-to-L transition probabilities are calculated, and the effective phase limit is derived. Due to the suppression of turbulence by shear in E r , the limit deviates from Maxwell's rule. The ensemble average of heat flux as well as that of E r do not show a hysteresis in contrast to the deterministic model. Experimental condition for observing the hysteresis is also addressed. (author)
Directory of Open Access Journals (Sweden)
Ayaga Bawah
Full Text Available This paper contributes evidence documenting the continued decline in all-cause mortality and changes in the cause of death distribution over time in four developing country populations in Africa and Asia. We present levels and trends in age-specific mortality (all-cause and cause-specific from four demographic surveillance sites: Agincourt (South Africa, Navrongo (Ghana in Africa; Filabavi (Vietnam, Matlab (Bangladesh in Asia. We model mortality using discrete time event history analysis. This study illustrates how data from INDEPTH Network centers can provide a comparative, longitudinal examination of mortality patterns and the epidemiological transition. Health care systems need to be reconfigured to deal simultaneously with continuing challenges of communicable disease and increasing incidence of non-communicable diseases that require long-term care. In populations with endemic HIV, long-term care of HIV patients on ART will add to the chronic care needs of the community.
Theory of high-T{sub C} superconductivity: transition temperature
Energy Technology Data Exchange (ETDEWEB)
Harshman, Dale R [Physikon Research Corporation, Lynden, WA 98264 (United States); Fiory, Anthony T [Department of Physics, New Jersey Institute of Technology, Newark, NJ 07102 (United States); Dow, John D, E-mail: drh@physikon.net [Department of Physics, Arizona State University, Tempe, AZ 85287 (United States)
2011-07-27
It is demonstrated that the transition temperature (T{sub C}) of high-T{sub C} superconductors is determined by their layered crystal structure, bond lengths, valency properties of the ions, and Coulomb coupling between electronic bands in adjacent, spatially separated layers. Analysis of 31 high-T{sub C} materials (cuprates, ruthenates, ruthenocuprates, iron pnictides, organics) yields the universal relationship for optimal compounds, k{sub B}T{sub C0} ={beta}/{iota}{zeta}, where {iota} is related to the mean spacing between interacting charges in the layers, {zeta} is the distance between interacting electronic layers, {beta} is a universal constant and T{sub C0} is the optimal transition temperature (determined to within an uncertainty of {+-} 1.4 K by this relationship). Non-optimum compounds, in which sample degradation is evident, e.g. by broadened superconducting transitions and diminished Meissner fractions, typically exhibit reduced T{sub C} < T{sub C0}. It is shown that T{sub C0} may be obtained from an average of the Coulomb interaction forces between the two layers.
Heavy baryon transitions and the heavy quark effective theory
International Nuclear Information System (INIS)
Hussain, F.
1992-01-01
Heavy baryon decays are studied in the context of the Bethe-Salpeter approach to the heavy quark effective theory. A drastic reduction, in the number of independent form factors, is found. Results are presented both for heavy to heavy and heavy to light baryon decays. (orig.)
Theory of the superconducting proximity effect below the transition temperature
International Nuclear Information System (INIS)
Silvert, W.
1975-01-01
The form of the low-temperature theory of the superconducting proximity effect depends on whether the non-linear terms are assumed to depend only on the local value of the gap or on its average value over some finite range. The local assumption leads to smaller values of the gap and to unphysical results at low temperatures. The effect of non-locality is significant even in the Ginsburg-Landau regime. (author)
Mean field theory of dynamic phase transitions in ferromagnets
International Nuclear Information System (INIS)
Idigoras, O.; Vavassori, P.; Berger, A.
2012-01-01
We have studied the second order dynamic phase transition (DPT) of the two-dimensional kinetic Ising model by means of numerical calculations. While it is well established that the order parameter Q of the DPT is the average magnetization per external field oscillation cycle, the possible identity of the conjugate field has been addressed only recently. In this work, we demonstrate that our entire set of numerical data is fully consistent with the applied bias field H b being the conjugate field of order parameter Q. For this purpose, we have analyzed the Q(H b )-dependence and we have found that it follows the expected power law behavior with the same critical exponent as the mean field equilibrium case.
Role of secondary instability theory and parabolized stability equations in transition modeling
El-Hady, Nabil M.; Dinavahi, Surya P.; Chang, Chau-Lyan; Zang, Thomas A.
1993-01-01
In modeling the laminar-turbulent transition region, the designer depends largely on benchmark data from experiments and/or direct numerical simulations that are usually extremely expensive. An understanding of the evolution of the Reynolds stresses, turbulent kinetic energy, and quantifies in the transport equations like the dissipation and production is essential in the modeling process. The secondary instability theory and the parabolized stability equations method are used to calculate these quantities, which are then compared with corresponding quantities calculated from available direct numerical simulation data for the incompressible boundary-layer flow of laminar-turbulent transition conditions. The potential of the secondary instability theory and the parabolized stability equations approach in predicting these quantities is discussed; results indicate that inexpensive data that are useful for transition modeling in the early stages of the transition region can be provided by these tools.
Piomelli, Ugo; Zang, Thomas A.; Speziale, Charles G.; Lund, Thomas S.
1990-01-01
An eddy viscosity model based on the renormalization group theory of Yakhot and Orszag (1986) is applied to the large-eddy simulation of transition in a flat-plate boundary layer. The simulation predicts with satisfactory accuracy the mean velocity and Reynolds stress profiles, as well as the development of the important scales of motion. The evolution of the structures characteristic of the nonlinear stages of transition is also predicted reasonably well.
Effective field theory and integrability in two-dimensional Mott transition
International Nuclear Information System (INIS)
Bottesi, Federico L.; Zemba, Guillermo R.
2011-01-01
Highlights: → Mott transition in 2d lattice fermion model. → 3D integrability out of 2D. → Effective field theory for Mott transition in 2d. → Double Chern-Simons. → d-Density waves. - Abstract: We study the Mott transition in a two-dimensional lattice spinless fermion model with nearest neighbors density-density interactions. By means of a two-dimensional Jordan-Wigner transformation, the model is mapped onto the lattice XXZ spin model, which is shown to possess a quantum group symmetry as a consequence of a recently found solution of the Zamolodchikov tetrahedron equation. A projection (from three to two space-time dimensions) property of the solution is used to identify the symmetry of the model at the Mott critical point as U q (sl(2)-circumflex)xU q (sl(2)-circumflex), with deformation parameter q = -1. Based on this result, the low-energy effective field theory for the model is obtained and shown to be a lattice double Chern-Simons theory with coupling constant k = 1 (with the standard normalization). By further employing the effective filed theory methods, we show that the Mott transition that arises is of topological nature, with vortices in an antiferromagnetic array and matter currents characterized by a d-density wave order parameter. We also analyze the behavior of the system upon weak coupling, and conclude that it undergoes a quantum gas-liquid transition which belongs to the Ising universality class.
Relativistic many-body theory of atomic transitions: the relativistic equation-of-motion approach
International Nuclear Information System (INIS)
Huang, K.N.
1981-01-01
An equation-of-motion approach is used to develop the relativistic many-body theory of atomic transitions. The relativistic equations of motion for transition matrices are formulated using techniques of quantum field theory. To reduce the equation of motion to a tractable form which is appropriate for numerical calculations, a graphical method is employed to resolve the complication arising from the antisymmetrization and angular momentum coupling. The relativistic equation-of-motion method allows an ab initio treatment of correlation and relativistic effects in both closed- and open-shell many-body systems. A special case of the present formulation reduces to the relativistic random-phase approximation
Eikonal theory of the transition to phase incoherence
International Nuclear Information System (INIS)
Kaufman, A.N.; Rosengaus, E.
1983-02-01
When a monochromatic electromagnetic wave propagates through a nonuniform plasma (of n dimensions), its refraction may be studied in terms of its family of rays in 2n-dimensional phase space (k,x). These rays generate and n-dimensional surface. Imbedded in the phase space. The wave amplitude and phase are defined on this surface. As the rays twist and separate (from the dynamics of the ray Hamiltonian), the surface develops pleats and becomes convoluted. Projection of the surface onto x-space then yields a multivalued k(x). The local spectral density, as a function of k for given x, exhibits sharp spikes at these k(x), in the ray-optics limit. The next correction yields a finite width to these spikes. As the surface becomes more and more pppleated, these spectral peaks overlap; the spectrum changes qualitatively from a line spectrum to a continuous spectrum. Correspondingly, the two-point spatial correlation function loses its long-range order, as the correlation volume contracts. This phenomenon is what we call the transition to incoherence
The Mott transition in the strong coupling perturbation theory
International Nuclear Information System (INIS)
Sherman, A.
2015-01-01
Using the strong coupling diagram technique a self-consistent equation for the electron Green's function is derived for the repulsive Hubbard model. Terms of two lowest orders of the ratio of the bandwidth Δ to the Hubbard repulsion U are taken into account in the irreducible part of the Larkin equation. The obtained equation is shown to retain causality and reduces to Green's function of uncorrelated electrons in the limit U→0. Calculations were performed for the semi-elliptical initial band. It is shown that the approximation describes the Mott transition, which occurs at U c =√(3)Δ/2. This value coincides with that obtained in the Hubbard-III approximation. At half-filling, for 0U c the Mott gap disappears
The Mott transition in the strong coupling perturbation theory
Sherman, A.
2015-01-01
Using the strong coupling diagram technique a self-consistent equation for the electron Green's function is derived for the repulsive Hubbard model. Terms of two lowest orders of the ratio of the bandwidth Δ to the Hubbard repulsion U are taken into account in the irreducible part of the Larkin equation. The obtained equation is shown to retain causality and reduces to Green's function of uncorrelated electrons in the limit U → 0. Calculations were performed for the semi-elliptical initial band. It is shown that the approximation describes the Mott transition, which occurs at Uc =√{ 3 } Δ / 2. This value coincides with that obtained in the Hubbard-III approximation. At half-filling, for 0 self-energy is nonzero at the Fermi level, which indicates that the obtained solution is not a Fermi liquid. At small deviations from half-filling the density of states shifts along the frequency axis without perceptible changes in its shape. For larger deviations the density of states is modified: it is redistributed in favor of the subband, in which the Fermi level is located, and for U >Uc the Mott gap disappears.
2015-05-01
vapor bubbles may generate near blades [40]. This is the phenomenon of cavitation and it is still a limiting factor for ship propeller design. Phase...van der Waals theory with hydrodynamics [39]. The fluid equations based on the van der Waals theory are called the Navier-Stokes-Korteweg equations... cavitating flows, the liquid- vapor phase transition induced by pressure variations. A potential challenge for such a simulation is a proper design of open
Second-order phase transition in gφ42 theory
International Nuclear Information System (INIS)
Ganbold, G.; Efimov, G.V.
1993-08-01
We have suggested a regular scheme for calculating systematically the leading term and next corrections to it up to the fourth order for the effective potential in the scalar φ 4 2 theory. The obtained results give evidence in favour of a second-order phase transition at (g/2πm 2 ) crit ≅ 0.9 in the theory under consideration. (author). 18 refs, 1 fig
Second order phase transition in two dimensional sine-Gordon field theory - lattice model
International Nuclear Information System (INIS)
Babu Joseph, K.; Kuriakose, V.C.
1978-01-01
Two dimensional sine-Gordon (SG) field theory on a lattice is studied using the single-site basis variational method of Drell and others. The nature of the phase transition associated with the spontaneous symmetry breakdown in a SG field system is clarified to be of second order. A generalisation is offered for a SG-type field theory in two dimensions with a potential of the form [cossup(n)((square root of lambda)/m)phi-1].(author)
Energy Technology Data Exchange (ETDEWEB)
Zinn-Justin, J
2003-08-01
In the quantum field theory the problem of infinite values has been solved empirically through a method called renormalization, this method is satisfying only in the framework of renormalization group. It is in the domain of statistical physics and continuous phase transitions that these issues are the easiest to discuss. Within the framework of a course in theoretical physics the author introduces the notions of continuous limits and universality in stochastic systems operating with a high number of freedom degrees. It is shown that quasi-Gaussian and mean field approximation are unable to describe phase transitions in a satisfying manner. A new concept is required: it is the notion of renormalization group whose fixed points allow us to understand universality beyond mean field. The renormalization group implies the idea that long distance correlations near the transition temperature might be described by a statistical field theory that is a quantum field in imaginary time. Various forms of renormalization group equations are presented and solved in particular boundary limits, namely for fields with high numbers of components near the dimensions 4 and 2. The particular case of exact renormalization group is also introduced. (A.C.)
Mean Field Theory, Ginzburg Criterion, and Marginal Dimensionality of Phase-Transitions
DEFF Research Database (Denmark)
Als-Nielsen, Jens Aage; Birgenau, R. J.
1977-01-01
By applying a real space version of the Ginzburg criterion, the role of fluctuations and thence the self‐consistency of mean field theory are assessed in a simple fashion for a variety of phase transitions. It is shown that in using this approach the concept of ’’marginal dimensionality’’ emerges...... in a natural way. For example, it is shown that for many homogeneous structural transformations the marginal dimensionality is two, so that mean field theory will be valid for real three‐dimensional systems. It is suggested that this simple self‐consistent approach to Landau theory should be incorporated...
Comparison of 3D Classical Trajectory and Transition-State Theory Reaction Cross Sections
Koeppl, G. W.; Karplus, Martin
1970-10-01
Although there is excellent agreement for a system such as H+H{sub 2} --> H{sub 2}+H, in which both the potential and the particle masses are symmetric, significant deviations occur for more asymmetric reactions. A detailed analysis show that the calculated differences are from the violation of two assumptions of transition-state theory.
Wigner's dynamical transition state theory in phase space : classical and quantum
Waalkens, Holger; Schubert, Roman; Wiggins, Stephen
We develop Wigner's approach to a dynamical transition state theory in phase space in both the classical and quantum mechanical settings. The key to our development is the construction of a normal form for describing the dynamics in the neighbourhood of a specific type of saddle point that governs
Short review on contemporary state of X-ray transition radiation theory
International Nuclear Information System (INIS)
Garibyan, G.M.
1977-01-01
The main properties of the X-ray transition radiation and the prehistory of the development of this phenomenon are given. The radiation produced when a charged particle passes through a regular and irregular stack of plates, the influence of the multiple scattering on the radiation as well as the microscopic theory of this phenomenon are considered
Theory for Explaining and Comparing the Dynamics of Education in Transitional Processes
van der Walt, Johannes L.
2016-01-01
Countries all over the world find themselves in the throes of revolution, change, transition or transformation. Because of the complexities of these momentous events, it is no simple matter to describe and evaluate them. This paper suggests that comparative educationists apply a combination of three theories as a lens through which such national…
Theory of direct-interband-transition line shapes based on Mori's method
International Nuclear Information System (INIS)
Sam Nyung Yi; Jai Yon Ryu; Ok Hee Chung; Joung Young Sug; Sang Don Choi; Yeon Choon Chung
1987-01-01
A theory of direct interband optical transition in the electron-phonon system is introduced on the basis of the Kubo formalism and by using Mori's method of calculation. The line shape functions are introduced in two different ways and are compared with those obtained by Choi and Chung based on Argyres and Sigel's projection technique
Phase transitions in the argon, krypton and xenon in generalized Van der Waals theory
International Nuclear Information System (INIS)
Cavalcanti, H.M.
1977-01-01
Fluid-solid like phase transitions for three monoatomic substances, argon, krypton and xenon are treated, using the extension of the Van der Waals theory to the crystalline state. The method utilized is based on 'Maxwell construction' of identical areas [pt
Atherley, Anique E; Hambleton, Ian R; Unwin, Nigel; George, Colette; Lashley, Paula M; Taylor, Charles G
2016-04-01
Transitions in medical education are emotionally and socially dynamic; this may affect learning. Students transitioning from preclinical to clinical training may experience negative consequences. Less is understood about students' experiences during transitions within clinical training and influential factors. The authors used organizational socialization theory to explore a transition within the clinical years. Final-year medical students experienced a nine-week internal medicine clerkship; willing students participated. Students (n = 101; 97 %) completed a questionnaire with open-ended questions at the beginning and end of the clerkship and participated in six consecutive focus groups, until data saturation occurred (n = 37). Data were thematically analyzed. Socialization was challenging. Many students experienced difficulty developing relationships with team members. Students with a positive attitude experienced a smoother transition. Many students were uncertain of their roles, concerned about the workload and desired guidance to meet clerkship demands. This transition resulted in varied outcomes from enjoyment, increased confidence and student development through to disinterest. Transitions within clinical training are complex. Faculty should focus on adequate socialization in a new clerkship as this may facilitate a smoother transition. This may necessitate orientations, staff training, and formal student support. Further research is needed on the impact of these recommendations on learning and well-being.
Klobučar, Nataša Rijavec
2016-08-01
This article presents results of a qualitative study of 12 adult couples making transition to parenthood. The aim of the study was to research the meaning of transition to parenthood through the lens of transformative learning theory. Transformative learning theory explains learning through meaning-making of that life experience. In this paper, the spiritual dimension of learning is emphasized. An important part of research methodology included biographical method, using semi-structured interviews before and after the birth of the first child. The research showed that transformative learning occurs in different spheres of life during transition to parenthood. This paper discusses the spiritual dimension of learning, meaning-making and presents results of the research.
International Nuclear Information System (INIS)
Kinoshita, Takehiro; Fujiyama, Shinya; Idogaki, Toshihiro; Tokita, Masahiko
2009-01-01
The non-equilibrium phase transition in a ferromagnetic Ising model is investigated by use of a new type of effective field theory (EFT) which correctly accounts for all the single-site kinematic relations by differential operator technique. In the presence of a time dependent oscillating external field, with decrease of the temperature the system undergoes a dynamic phase transition, which is characterized by the period averaged magnetization Q, from a dynamically disordered state Q = 0 to the dynamically ordered state Q ≠ 0. The results of the dynamic phase transition point T c determined from the behavior of the dynamic magnetization and the Liapunov exponent provided by EFT are improved than that of the standard mean field theory (MFT), especially for the one dimensional lattice where the standard MFT gives incorrect result of T c = 0 even in the case of zero external field.
Thermal isomerization of azobenzenes: on the performance of Eyring transition state theory
Rietze, Clemens; Titov, Evgenii; Lindner, Steven; Saalfrank, Peter
2017-08-01
The thermal Z\\to E (back-)isomerization of azobenzenes is a prototypical reaction occurring in molecular switches. It has been studied for decades, yet its kinetics is not fully understood. In this paper, quantum chemical calculations are performed to model the kinetics of an experimental benchmark system, where a modified azobenzene (AzoBiPyB) is embedded in a metal-organic framework (MOF). The molecule can be switched thermally from cis to trans, under solvent-free conditions. We critically test the validity of Eyring transition state theory for this reaction. As previously found for other azobenzenes (albeit in solution), good agreement between theory and experiment emerges for activation energies and activation free energies, already at a comparatively simple level of theory, B3LYP/6-31G* including dispersion corrections. However, theoretical Arrhenius prefactors and activation entropies are in qualitiative disagreement with experiment. Several factors are discussed that may have an influence on activation entropies, among them dynamical and geometric constraints (imposed by the MOF). For a simpler model—Z\\to E isomerization in azobenzene—a systematic test of quantum chemical methods from both density functional theory and wavefunction theory is carried out in the context of Eyring theory. Also, the effect of anharmonicities on activation entropies is discussed for this model system. Our work highlights capabilities and shortcomings of Eyring transition state theory and quantum chemical methods, when applied for the Z\\to E (back-)isomerization of azobenzenes under solvent-free conditions.
Theory of structural phase transition in MgTi{sub 2}O{sub 4}
Energy Technology Data Exchange (ETDEWEB)
Talanov, V. M., E-mail: valtalanov@mail.ru [South Russian State Polytechnical University (Russian Federation); Shirokov, V. B. [Russian Academy of Sciences, South Science Centre (Russian Federation); Ivanov, V. V. [South Russian State Polytechnical University (Russian Federation); Talanov, M. V. [South Federal University (Russian Federation)
2015-01-15
A theory of phase transition in MgTi{sub 2}O{sub 4} is proposed based on a study of the order-parameter symmetry, thermodynamics, and mechanisms of formation of the atomic and orbital structure of the low-symmetry MgTi{sub 2}O{sub 4} phase. The critical order parameter (which induces a phase transition) is determined. It is shown that the calculated MgTi{sub 2}O{sub 4} tetragonal structure is a result of displacements of magnesium, titanium, and oxygen atoms; ordering of oxygen atoms; and the participation of d{sub xy}, d{sub xz}, and d{sub yz} orbitals. The contribution of noncritical representations to ion displacements is proven to be insignificant. The existence of various metal clusters in the tetragonal phase has been established by calculation in correspondence with experimental data. It is shown (within the Landau theory of phase transitions) that phase states can be changed as a result of both first- and second-order phase transitions: the high-symmetry phase borders two low-symmetry phases by second-order transition lines, while the border between low-symmetry phases is a first-order transition line.
Relaxation theory of spin-3/2 Ising system near phase transition temperatures
International Nuclear Information System (INIS)
Canko, Osman; Keskin, Mustafa
2010-01-01
Dynamics of a spin-3/2 Ising system Hamiltonian with bilinear and biquadratic nearest-neighbour exchange interactions is studied by a simple method in which the statistical equilibrium theory is combined with the Onsager's theory of irreversible thermodynamics. First, the equilibrium behaviour of the model in the molecular-field approximation is given briefly in order to obtain the phase transition temperatures, i.e. the first- and second-order and the tricritical points. Then, the Onsager theory is applied to the model and the kinetic or rate equations are obtained. By solving these equations three relaxation times are calculated and their behaviours are examined for temperatures near the phase transition points. Moreover, the z dynamic critical exponent is calculated and compared with the z values obtained for different systems experimentally and theoretically, and they are found to be in good agrement. (general)
Possible higher order phase transition in large-N gauge theory at finite temperature
Energy Technology Data Exchange (ETDEWEB)
Nishimura, Hiromichi
2017-08-07
We analyze the phase structure of SU(¥) gauge theory at finite temperature using matrix models. Our basic assumption is that the effective potential is dominated by double-trace terms for the Polyakov loops. As a function of the temperature, a background field for the Polyakov loop, and a quartic coupling, it exhibits a universal structure: in the large portion of the parameter space, there is a continuous phase transition analogous to the third-order phase transition of Gross,Witten and Wadia, but the order of phase transition can be higher than third. We show that different confining potentials give rise to drastically different behavior of the eigenvalue density and the free energy. Therefore lattice simulations at large N could probe the order of phase transition and test our results. Critical
Non-Douglas-Kazakov phase transition of two-dimensional generalized Yang-Mills theories
International Nuclear Information System (INIS)
Khorrami, M.; Alimohammadi, M.
2007-01-01
In two-dimensional Yang-Mills and generalized Yang-Mills theories for large gauge groups, there is a dominant representation determining the thermodynamic limit of the system. This representation is characterized by a density, the value of which should everywhere be between zero and one. This density itself is determined by means of a saddle-point analysis. For some values of the parameter space, this density exceeds one in some places. So one should modify it to obtain an acceptable density. This leads to the well-known Douglas-Kazakov phase transition. In generalized Yang-Mills theories, there are also regions in the parameter space where somewhere this density becomes negative. Here too, one should modify the density so that it remains nonnegative. This leads to another phase transition, different from the Douglas-Kazakov one. Here the general structure of this phase transition is studied, and it is shown that the order of this transition is typically three. Using carefully-chosen parameters, however, it is possible to construct models with the order of the phase transition not equal to three. A class of these non-typical models is also studied. (orig.)
The Ebb and Flow of Filipino First-Time Fatherhood Transition Space: A Grounded Theory Study.
Villamor, Neil Jupiter E; de Guzman, Allan B; Matienzo, Evangeline T
2016-11-01
Fatherhood, as a developmental process, is both a human experience and a text that needs to be read. For developing nations like the Philippines, little is known about the process undergone by first-time fathers on their transition to fatherhood, and how nurses can play a significant role in assisting them. This grounded theory study purported to conceptualize the multifaceted process of transition from the lens of Filipino first-time fathers' lived experiences. A total of 20 first-time fathers from Metro Manila, Philippines, were purposively selected to take part in an individual, semistructured, and in-depth interview. The Glaserian (classical) method of analysis was specifically used, and field texts were inductively analyzed using a repertory grid. Member checking and correspondence were done to validate the findings of the study. Six surfacing stages emerged relative to the process of transition. Interestingly, The B.R.I.D.G.E. Theory of First-Time Fatherhood Transition Space describes how these fathers progress from the beholding, reorganizing, inhibiting, delivering, grasping, and embracing phases toward successful transition. This emerged theoretical model can be used in framing health care programs where the needs of fathers during this period are met and addressed. Finally, it can also be used in guiding nurses in their provision of a more empathetic care for first-time fathers. © The Author(s) 2015.
Ndahindwa, Vedaste; Kamanzi, Collins; Semakula, Muhammed; Abalikumwe, François; Hedt-Gauthier, Bethany; Thomson, Dana R
2014-12-13
Major improvements to Rwanda's health system, infrastructure, and social programs over the last decade have led to a rapid fertility transition unique from other African countries. The total fertility rate fell from 6.1 in 2005 to 4.6 in 2010, with a 3-fold increase in contraceptive usage. Despite this rapid national decline, many women still have large numbers of children. This study investigates predictors of fertility during this fertility transition to inform policies that improve individuals' reproductive health and guide national development. We used Poisson regression to separately model number of children born to ever married/cohabitated women (n = 8,309) and never married women (n = 1,220) age 15 to 49 based on 2010 Rwanda Demographic and Health Survey data. We used backward stepwise regression with a time offset to identify individual and household factors associated with woman's fertility level, accounting for sampling weights, clustering, and stratification. In ever married/cohabitating women, high fertility was significantly associated (p Rwanda's national fertility rate and support families to achieve their desired fertility. Strategies include policies and programs that promote delayed sexual debut via educational and economic opportunities for women, improved access to reproductive health information and services at schools and via health campaigns, and involvement of men in family planning decision making.
DEFF Research Database (Denmark)
Lindgård, Per-Anker; Mouritsen, Ole G.
1990-01-01
We discuss central questions in weak, first-order structural transitions by means of a magnetic analog model. A theory including fluctuation effects is developed for the model, showing a dynamical response with softening, fading modes and a growing central peak. The model is also analyzed by a two......-dimensional Monte Carlo simulation, showing clear precursor phenomena near the first-order transition and spontaneous nucleation. The kinetics of the domain growth is studied and found to be exceedingly slow. The results are applicable for martensitic transformations and structural surface...
International Nuclear Information System (INIS)
Jagla, E A
2004-01-01
I study the buckling transition under compression of a two-dimensional, hexagonal, regular elastic honeycomb. Under isotropic compression, the system buckles to a configuration consisting of a unit cell containing four of the original hexagons. This buckling pattern preserves the sixfold rotational symmetry of the original lattice but is chiral, and can be described as a combination of three different elemental distortions in directions rotated by 2π/3 from each other. Non-isotropic compression may induce patterns consisting of a single elemental distortion or a superposition of two of them. The numerical results compare very well with the outcome of a Landau theory of second-order phase transitions
Cornia, Giovanni Andrea
This is a report sponsored by UNICEF on the effects of economic and political transition in Europe, particularly Eastern Europe, on young children and adolescents. The economic theories and changes in labor and markets which have characterized European transitions in the past few years have paid little attention to issues of poverty and child…
Critical temperature for shape transition in hot nuclei within covariant density functional theory
Zhang, W.; Niu, Y. F.
2018-05-01
Prompted by the simple proportional relation between critical temperature for pairing transition and pairing gap at zero temperature, we investigate the relation between critical temperature for shape transition and ground-state deformation by taking even-even Cm-304286 isotopes as examples. The finite-temperature axially deformed covariant density functional theory with BCS pairing correlation is used. Since the Cm isotopes are the newly proposed nuclei with octupole correlations, we studied in detail the free energy surface, the Nilsson single-particle (s.p.) levels, and the components of s.p. levels near the Fermi level in 292Cm. Through this study, the formation of octupole equilibrium is understood by the contribution coming from the octupole driving pairs with Ω [N ,nz,ml] and Ω [N +1 ,nz±3 ,ml] for single-particle levels near the Fermi surfaces as it provides a good manifestation of the octupole correlation. Furthermore, the systematics of deformations, pairing gaps, and the specific heat as functions of temperature for even-even Cm-304286 isotopes are discussed. Similar to the relation between the critical pairing transition temperature and the pairing gap at zero temperature Tc=0.6 Δ (0 ) , a proportional relation between the critical shape transition temperature and the deformation at zero temperature Tc=6.6 β (0 ) is found for both octupole shape transition and quadrupole shape transition for the isotopes considered.
Theory of quantum metal to superconductor transitions in highly conducting systems
Energy Technology Data Exchange (ETDEWEB)
Spivak, B.
2010-04-06
We derive the theory of the quantum (zero temperature) superconductor to metal transition in disordered materials when the resistance of the normal metal near criticality is small compared to the quantum of resistivity. This can occur most readily in situations in which 'Anderson's theorem' does not apply. We explicitly study the transition in superconductor-metal composites, in an swave superconducting film in the presence of a magnetic field, and in a low temperature disordered d-wave superconductor. Near the point of the transition, the distribution of the superconducting order parameter is highly inhomogeneous. To describe this situation we employ a procedure which is similar to that introduced by Mott for description of the temperature dependence of the variable range hopping conduction. As the system approaches the point of the transition from the metal to the superconductor, the conductivity of the system diverges, and the Wiedemann-Franz law is violated. In the case of d-wave (or other exotic) superconductors we predict the existence of (at least) two sequential transitions as a function of increasing disorder: a d-wave to s-wave, and then an s-wave to metal transition.
Relativistic many-body theory of atomic transitions. The relativistic equation-of-motion approach
International Nuclear Information System (INIS)
Huang, K.
1982-01-01
An equation-of-motion approach is used to develop the relativistic many-body theory of atomic transitions. The relativistic equations of motion for transition matrices are formulated with the use of techniques of quantum-field theory. To reduce the equations of motion to a tractable form which is appropriate for numerical calculations, a graphical method to resolve the complication arising from the antisymmetrization and angular-momentum coupling is employed. The relativistic equation-of-motion method allows an ab initio treatment of correlation and relativistic effects in both closed- and open-shell many-body systems. A special case of the present formulation reduces to the relativistic random-phase approximation
International Nuclear Information System (INIS)
Kuchinskii, E. Z.; Nekrasov, I. A.; Sadovskii, M. V.
2008-01-01
The DOS, the dynamic (optical) conductivity, and the phase diagram of a strongly correlated and strongly disordered paramagnetic Anderson-Hubbard model are analyzed within the generalized dynamical mean field theory (DMFT + Σ approximation). Strong correlations are taken into account by the DMFT, and disorder is taken into account via an appropriate generalization of the self-consistent theory of localization. The DMFT effective single-impurity problem is solved by a numerical renormalization group (NRG); we consider the three-dimensional system with a semielliptic DOS. The correlated metal, Mott insulator, and correlated Anderson insulator phases are identified via the evolution of the DOS and dynamic conductivity, demonstrating both the Mott-Hubbard and Anderson metal-insulator transition and allowing the construction of the complete zero-temperature phase diagram of the Anderson-Hubbard model. Rather unusual is the possibility of a disorder-induced Mott insulator-to-metal transition
Quantum Debye-Hueckel theory and the possible plasma phase transition
International Nuclear Information System (INIS)
Baker, G. Jr.
1998-01-01
In this paper the author first sketches the calculation of the pressure of a neutral, ion-electron gas as an expansion in powers of the electron charge, e, by means of the Matsubara, finite-temperature, many-body, perturbation theory. He then goes on to derive the Debye-Hue term and other equations to support his contentions. His results support but do not prove the existence of a phase transition
Field theory of absorbing phase transitions with a non-diffusive conserved field
International Nuclear Information System (INIS)
Pastor-Satorras, R.; Vespignani, A.
2000-04-01
We investigate the critical behavior of a reaction-diffusion system exhibiting a continuous absorbing-state phase transition. The reaction-diffusion system strictly conserves the total density of particles, represented as a non-diffusive conserved field, and allows an infinite number of absorbing configurations. Numerical results show that it belongs to a wide universality class that also includes stochastic sandpile models. We derive microscopically the field theory representing this universality class. (author)
Meerson, Baruch; Smith, Naftali R.
2018-01-01
De la Cruz et al. [Phys. Rev. Lett. 120, 128102 (2018); arXiv:1705.08683] studied a noise-induced transition in an oscillating stochastic population undergoing birth- and death-type reactions. They applied the Freidlin-Wentzell WKB formalism to determine the most probable path to the noise-induced escape from a limit cycle predicted by deterministic theory, and to find the probability distribution of escape time. Here we raise a number of objections to their calculations.
Fracture and healing of elastomers: A phase-transition theory and numerical implementation
Kumar, Aditya; Francfort, Gilles A.; Lopez-Pamies, Oscar
2018-03-01
A macroscopic theory is proposed to describe, explain, and predict the nucleation and propagation of fracture and healing in elastomers undergoing arbitrarily large quasistatic deformations. The theory, which can be viewed as a natural generalization of the phase-field approximation of the variational theory of brittle fracture of Francfort and Marigo (1998) to account for physical attributes innate to elastomers that have been recently unveiled by experiments at high spatio-temporal resolution, rests on two central ideas. The first one is to view elastomers as solids capable to undergo finite elastic deformations and capable also to phase transition to another solid of vanishingly small stiffness: the forward phase transition serves to model the nucleation and propagation of fracture while the reverse phase transition models the possible healing. The second central idea is to take the phase transition to be driven by the competition between a combination of strain energy and hydrostatic stress concentration in the bulk and surface energy on the created/healed new surfaces in the elastomer. From an applications point of view, the proposed theory amounts to solving a system of two coupled and nonlinear PDEs for the deformation field and an order parameter, or phase field. A numerical scheme is presented to generate solutions for these PDEs in N = 2 and 3 space dimensions. This is based on an efficient non-conforming finite-element discretization, which remains stable for large deformations and elastomers of any compressibility, together with an implicit gradient flow solver, which is able to deal with the large changes in the deformation field that can ensue locally in space and time from the nucleation of fracture. The last part of this paper is devoted to presenting sample simulations of the so-called Gent-Park experiment. Those are confronted with recent experimental results for various types of silicone elastomers.
Transition state theory approach to polymer escape from a one dimensional potential well.
Mökkönen, Harri; Ikonen, Timo; Ala-Nissila, Tapio; Jónsson, Hannes
2015-06-14
The rate of escape of an ideal bead-spring polymer in a symmetric double-well potential is calculated using transition state theory (TST) and the results compared with direct dynamical simulations. The minimum energy path of the transitions becomes flat and the dynamics diffusive for long polymers making the Kramers-Langer estimate poor. However, TST with dynamical corrections based on short time trajectories started at the transition state gives rate constant estimates that agree within a factor of two with the molecular dynamics simulations over a wide range of bead coupling constants and polymer lengths. The computational effort required by the TST approach does not depend on the escape rate and is much smaller than that required by molecular dynamics simulations.
Reactive scattering theory for molecular transitions in time-dependent fields
International Nuclear Information System (INIS)
Peskin, U.; Miller, W.H.
1995-01-01
A new approach is introduced for computing probabilities of molecular transitions in time-dependent fields. The method is based on the stationary (t,t') representation of the Schroedinger equation and is shown to be equivalent to infinite order time-dependent perturbation theory. Bound-to-bound (i.e., photoexcitation) and bound-to-continuum (i.e., photoreaction) transitions are regarded as reactive collisions with the ''time coordinate'' as the reaction coordinate in an extended Hilbert space. A numerical method based on imposing absorbing boundary conditions for the time coordinate in a discrete variable representation framework is introduced. A single operation of the Green's operator provides all the state-specific transition probabilities as well as partial state-resolved (inclusive) reaction probabilities. Illustrative numerical applications are given for model systems
Gender inequalities from the demographic perspective
Directory of Open Access Journals (Sweden)
Devedžić Mirjana
2006-01-01
Full Text Available The paper analyzes the meaning of the phrase "the woman’s status in the society" that is recognized in demography as an important cultural factor of demographic development and transitional changes. The analysis indicates qualitative shifts in the woman’s status and simultaneously reveals its importance at present, not only in traditional, but also in modern and developed societies. On the other hand, it explains the importance of sex as a biodemographic determinant, and introduces the concept of gender that sheds another light on the concepts of sex and woman’s status in the society and integrates them. Gender regimes that subsume the inferiority of women in public and private social structures are examined from demographic perspective, albeit only in those phenomenological aspects that can be supported by demographic research, theories, and analyses. To this end, the paper analyzes the effects of strengthening gender equalities on the fertility and mortality transitions, the gender’s impact on the population distribution by sex in South Asian countries, and highlights the key role of gender in interpreting certain social and economic structures. It also stresses the establishing of gender equality as an important element of population policies. The global dimension of the patriarchal society is illustrated through a series of examples of demographic phenomena from various societies. Gender regimes underlie all of these phenomena. The paper puts foreword certain theoretical hypotheses about gender inequalities, and finds their connections with demographic behaviors and demographic indicators. Finally, it summarizes the role of demography in gender (inequality research and the demographic perspective of the way and the speed the demographic equality is being established. Demography is seen as an irreplaceable discipline in examining gender inequalities, especially at the global level. With the advance of qualitative methods in demography
International Nuclear Information System (INIS)
Garrett, B.C.; Truhlar, D.G.; Grev, R.S.
1981-01-01
Accurate classical dynamical fixed-energy reaction probabilities and fixed-temperature rate constants are calculated for the collinear reaction H + FH on a low-barrier model potential energy surface. The calculations cover energies from 0.1 to 100 kcal/mol above threshold and temperatures of 100 to 10,000 K. The accurate results are used to test five approximate theories: conventional transition-state theory (TST), canonical variational theory (CVT), improved canonical variational theory (ICVT), microcanonical variational theory (μVT), and the unified statistical model (US). The first four of these theories involve a single dividing surface in phase space, and the US theory involves three dividing surfaces. The tests are particularly interesting because the potential energy surface has two identical saddle points. At temperatures from 100 to 2000 K, the μVt is the most accurate theory, with errors in the range 11 to 14%; for temperatures from 2000 to 10,000 K, the US theory is the most successful, with errors in the range 3 to 14%. Over the whole range, a factor of 100 in temperature, both theories have errors of 35% or less. Even TST has errors of 47% or less over the whole factor-of-100 temperature range. Although the US model should become exact at threshold for this system, it already underestimates the reaction probability by a factor of 0.64 at 0.1 kcal/mol above threshold. TST and μVT agree with each other within 12% up to an energy 13 kcal/mol above the saddle point energy. 3 figures, 2 tables
Deconfinement phase transition in the Hamiltonian approach to Yang–Mills theory in Coulomb gauge
Directory of Open Access Journals (Sweden)
Reinhardt H.
2014-04-01
Full Text Available Recent results obtained for the deconfinement phase transition within the Hamiltonian approach to Yang–Mills theory are reviewed. Assuming a quasiparticle picture for the grand canonical gluon ensemble the thermal equilibrium state is found by minimizing the free energy with respect to the quasi-gluon energy. The deconfinement phase transition is accompanied by a drastic change of the infrared exponents of the ghost and gluon propagators. Above the phase transition the ghost form factor remains infrared divergent but its infrared exponent is approximately halved. The gluon energy being infrared divergent in the confined phase becomes infrared finite in the deconfined phase. Furthermore, the effective potential of the order parameter for confinement is calculated for SU(N Yang–Mills theory in the Hamiltonian approach by compactifying one spatial dimension and using a background gauge fixing. In the simplest truncation, neglecting the ghost and using the ultraviolet form of the gluon energy, we recover the Weiss potential. From the full non-perturbative potential (with the ghost included we extract a critical temperature of the deconfinement phase transition of 269 MeV for the gauge group SU(2 and 283 MeV for SU(3.
Carlson, Rebecca K; Li Manni, Giovanni; Sonnenberger, Andrew L; Truhlar, Donald G; Gagliardi, Laura
2015-01-13
Kohn-Sham density functional theory, resting on the representation of the electronic density and kinetic energy by a single Slater determinant, has revolutionized chemistry, but for open-shell systems, the Kohn-Sham Slater determinant has the wrong symmetry properties as compared to an accurate wave function. We have recently proposed a theory, called multiconfiguration pair-density functional theory (MC-PDFT), in which the electronic kinetic energy and classical Coulomb energy are calculated from a multiconfiguration wave function with the correct symmetry properties, and the rest of the energy is calculated from a density functional, called the on-top density functional, that depends on the density and the on-top pair density calculated from this wave function. We also proposed a simple way to approximate the on-top density functional by translation of Kohn-Sham exchange-correlation functionals. The method is much less expensive than other post-SCF methods for calculating the dynamical correlation energy starting with a multiconfiguration self-consistent-field wave function as the reference wave function, and initial tests of the theory were quite encouraging. Here, we provide a broader test of the theory by applying it to bond energies of main-group molecules and transition metal complexes, barrier heights and reaction energies for diverse chemical reactions, proton affinities, and the water dimerization energy. Averaged over 56 data points, the mean unsigned error is 3.2 kcal/mol for MC-PDFT, as compared to 6.9 kcal/mol for Kohn-Sham theory with a comparable density functional. MC-PDFT is more accurate on average than complete active space second-order perturbation theory (CASPT2) for main-group small-molecule bond energies, alkyl bond dissociation energies, transition-metal-ligand bond energies, proton affinities, and the water dimerization energy.
Zhang, Zhaohuang; Meng, Liang; Sun, Fei
2013-05-01
At present, the inner cutters of a full face rock tunnel boring machine (TBM) and transition cutter edge angles are designed on the basis of indentation test or linear grooving test. The inner and outer edge angles of disc cutters are characterized as symmetric to each other with respect to the cutter edge plane. This design has some practical defects, such as severe eccentric wear and tipping, etc. In this paper, the current design theory of disc cutter edge angle is analyzed, and the characteristics of the rock-breaking movement of disc cutters are studied. The researching results show that the rotational motion of disc cutters with the cutter head gives rise to the difference between the interactions of inner rock and outer rock with the contact area of disc cutters, with shearing and extrusion on the inner rock and attrition on the outer rock. The wear of disc cutters at the contact area is unbalanced, among which the wear in the largest normal stress area is most apparent. Therefore, a three-dimensional model theory of rock breaking and an edge angle design theory of transition disc cutter are proposed to overcome the flaws of the currently used TBM cutter heads, such as short life span, camber wearing, tipping. And a corresponding equation is established. With reference to a specific construction case, the edge angle of the transition disc cutter has been designed based on the theory. The application of TBM in some practical project proves that the theory has obvious advantages in enhancing disc cutter life, decreasing replacement frequency, and making economic benefits. The proposed research provides a theoretical basis for the design of TBM three-dimensional disc cutters whose rock-breaking operation time can be effectively increased.
Bao, Junwei Lucas; Zheng, Jingjing; Truhlar, Donald G
2016-03-02
Pressure-dependent reactions are ubiquitous in combustion and atmospheric chemistry. We employ a new calibration procedure for quantum Rice-Ramsperger-Kassel (QRRK) unimolecular rate theory within a chemical activation mechanism to calculate the pressure-falloff effect of a radical association with an aromatic ring. The new theoretical framework is applied to the reaction of H with toluene, which is a prototypical reaction in the combustion chemistry of aromatic hydrocarbons present in most fuels. Both the hydrogen abstraction reactions and the hydrogen addition reactions are calculated. Our system-specific (SS) QRRK approach is adjusted with SS parameters to agree with multistructural canonical variational transition state theory with multidimensional tunneling (MS-CVT/SCT) at the high-pressure limit. The new method avoids the need for the usual empirical estimations of the QRRK parameters, and it eliminates the need for variational transition state theory calculations as a function of energy, although in this first application we do validate the falloff curves by comparing SS-QRRK results without tunneling to multistructural microcanonical variational transition state theory (MS-μVT) rate constants without tunneling. At low temperatures, the two approaches agree well with each other, but at high temperatures, SS-QRRK tends to overestimate falloff slightly. We also show that the variational effect is important in computing the energy-resolved rate constants. Multiple-structure anharmonicity, torsional-potential anharmonicity, and high-frequency-mode vibrational anharmonicity are all included in the rate computations, and torsional anharmonicity effects on the density of states are investigated. Branching fractions, which are both temperature- and pressure-dependent (and for which only limited data is available from experiment), are predicted as a function of pressure.
McDonald, Suzanne; O'Brien, Nicola; White, Martin; Sniehotta, Falko F
2015-02-21
There are considerable inter-individual differences in the direction and degree of change in physical activity (PA) levels during the retirement transition. There is currently a limited theoretical understanding of how these differences can be explained. This study aimed to explore and compare perceptions about how theory-based factors influence PA change during the transition from employment to retirement among individuals approaching retirement and recently retired. Theory-based, one-to-one, semi-structured interviews were conducted with a purposive sample of 28 adults (15 retired) within 24 months of retirement. Participants were sampled to reflect a diverse range of socio-economic and occupational backgrounds. The interview was based on the 12 domains within the Theory Domain Framework and designed to elicit anticipated or experienced retirement-related changes in PA behaviour and perceived determinants. Interview transcripts were analysed using Framework analysis to explore intra- and inter-individual perceptions of how PA changes after retirement and the factors which may influence this change. The majority of participants perceived retirement to be related to an increase in PA levels. Four themes emerged from the data regarding factors perceived to influence changes in PA behaviour after retirement: (1) resources for PA; (2) structure of daily life in retirement; (3) opportunities for PA; and (4) transitional PA phases after retirement. Retirement is associated with a number of inter-related changes and opportunities which can have a positive or negative impact on PA behaviour. The influence of these factors does not appear to be static and may change over time. A number of different transitional phases may be experienced after leaving work and each phase may have a differential impact on PA behaviour. The findings of this qualitative study contribute to the theoretical understanding of PA change during the retirement transition. Each post-retirement PA
International Nuclear Information System (INIS)
Kerres, U.; Mack, G.; Palma, G.
1994-12-01
We propose the study of the phase transition in the scalar electroweak theory at finite temperature by a two-step method. It combines i) dimensional reduction to a 3-dimensional lattice theory via perturbative blockspin transformation, and ii) either further real space renormalization group transformations, or solution of gap equations, for the 3d lattice theory. A gap equation can be obtained by using the Peierls inequality to find the best quadratic approximation to the 3d action. This method avoids the lack of self consistency of the usual treatments which do not separate infrared and UV-problems by introduction of a lattice cutoff. The effective 3d lattice action could also be used in computer simulations. (orig.)
International Nuclear Information System (INIS)
Kerres, U.
1995-01-01
We propose the study of the phase transition in the scalar electroweak theory at finite temperature by a two-step method. It combines i) dimensional reduction to a 3-dimensional lattice theory via perturbative blockspin transformation, and ii) either further real space renormalization group transformations, or solution of gap equations, for the 3d lattice theory. A gap equation can be obtained by using the Peierls inequality to find the best quadratic approximation to the 3d action. This method avoids the lack of self consistency of the usual treatments which do not separate infrared and UV-problems by introduction of a lattice cutoff. The effective 3d lattice action could also be used in computer simulations. ((orig.))
Bystrov, Evgenia
2014-01-01
Artikkel keskendub küsimusele, millised on seosed väärtusorientatsiooni ja perekonna käitumise vahel, aluseks maailma väärtusuuringu andmeid aastatest 1981-2008 ning lisaks veel 45 riigi andmed abielude kohta. Esindatud on ka Eesti
Variational transition-state theory. Progress report, February 1981-January 1983
International Nuclear Information System (INIS)
Truhlar, D.G.
1983-01-01
During the past two years we have extended the variational transition-state theory in several ways. Especially notable is that we have developed several new methods for calculating tunneling probabilities, including two general techniques applicable to systems with small and large reaction-path curvature. We have tested these methods successfully against accurate quantal calculations, and we have applied them to real systems in three dimensions. We have also developed general algorithms for variational transition state theory calculations on polyatomic systems and we have applied these to the combustion reaction OH + H 2 → H 2 O + H. We have developed and successfully applied a statistical-diabatic theory for state-selected rates. We made a totally ab initio prediction of an absolute chemical reaction rate, for the reaction Mu + H 2 → MuH + H, using an accurate potential energy surface and ethods that we had demonstrated to be reliable by tests against accurate quantal collinear results. This prediction has now been confirmed by unpublished experiments; I believe that this is the first reliable ab initio prediction of a chemical rection rate prior to its measurement. In the rest of this technical progress report we give further details of these and other studies we have carried out in the last two years under this contract
The Geography of Solar Photovoltaics (PV and a New Low Carbon Urban Transition Theory
Directory of Open Access Journals (Sweden)
Peter Newton
2013-06-01
Full Text Available This paper examines the early phases of a 21st century energy transition that involves distributed generation technologies employing low or zero carbon emission power sources and their take-up within Australia, with particular reference to the major cities and solar photovoltaics (PV. This transition is occurring in a nation with significant path dependency to overcome in relation to fossil fuel use. Tracking the diffusion of solar PV technology within Australia over the past decade provides a basis for assessing those factors underpinning its exponential growth and its associated geography of diffusion. Positive evidence that there are pathways for cities to decarbonise is apparent but there appear to be different pathways for different city forms with lower density suburban areas showing the biggest take-up of household-based energy technologies. This suggests a model for the low carbon urban transition involving combinations of simple technological changes and harder structural changes, depending upon which parts of the urban fabric are in focus. This is being called a New Low Carbon Urban Transition Theory.
Peake, Sharon; McDowall, Almuth
2012-01-01
In a rapidly changing world of work, little research exists on mid-career transitions. We investigated these using the open-systems approach of chaos theory as a guiding metaphor and conducted interviews with seven mid-career individuals chosen for their experience of a significant mid-career transition. Four common themes were identified through…
Experimental and theoretical examples of the value and limitations of transition state theory
International Nuclear Information System (INIS)
Golden, D.M.
1979-01-01
Value and limitations of transition-state theory (TST) are reviewed. TST analyses of the temperature dependence of the ''direct'' reactions CH 3 + CH 3 CHO → CH 4 + CH 3 CO (1) and O + CH 4 → OH + CH 3 (2) are presented in detail, and other examples of TST usefulness are recalled. Limitations are discussed for bimolecular processes in terms of ''complex'' vs ''direct'' mechanisms. The reaction OH + CO → CO 2 + H is discussed in this context. Limitations for unimolecular processes seem to arise only for simple bond fission processes, and recent advances are noted. 2 figures, 5 tables
Experimental and theoretical examples of the value and limitations of transition state theory
Golden, D. M.
1979-01-01
Value and limitations of transition-state theory (TST) are reviewed. TST analyses of the temperature dependence of the 'direct' reactions CH3 + CH3CHO yields CH4 + CH3CO(1) and O + CH4 yields OH + CH3(2) are presented in detail, and other examples of TST usefulness are recalled. Limitations are discussed for bimolecular processes in terms of 'complex' vs. 'direct' mechanisms. The reaction OH + CO yields CO2 + H is discussed in this context. Limitations for unimolecular processes seem to arise only for simple bond fission processes, and recent advances are noted.
Berezhkovskii, Alexander M.; Frishman, Anatoli M.; Pollak, Eli
1994-09-01
Variational transition state theory (VTST) is applied to the study of the activated escape of a particle trapped in a multidimensional potential well and coupled to a heat bath. Special attention is given to the dependence of the rate constant on the friction coefficients in the case of anisotropic friction. It is demonstrated explicitly that both the traditional as well as the nontraditional scenarios for the particle escape are recovered uniformly within the framework of VTST. Effects such as saddle point avoidance and friction dependence of the activation energy are derived from VTST using optimized planar dividing surfaces.
Tribbia, John Luke
. The STIRPAT method is used to test four social theories of environmental degradation -- the treadmill of production, ecological modernization, urban ecological transitions, and human ecology theories -- by quantifying variables associated with energy use and CO2 emissions drawn from each theory. The specific findings demonstrate that various demographic, economic, and governmental factors are related strongly to metropolitan area energy consumption and county-level CO2 emissions. The human ecology, treadmill of production, and urban ecological transitions theories are important to explaining how and why climate-related impacts differ for a wide variety of local areas in the United States. Related to human ecology and treadmill of production theory, environmental degradation is highest in metropolitan areas and counties with large populations and large economies that have various mechanisms in place to facilitate economic growth. By contrast, some U.S. counties are beginning to remedy their impact on the environment by applying economic and governmental resources toward the mitigation of CO2 emissions, which provides evidence of support for urban ecological transitions theory. However, because climate change is a complex cross-scale global environmental problem and the results in this dissertation confirm that this problem is locally driven by similar population and economic factors also affecting the climate at larger spatial scales, mitigation efforts to reduce energy use and emissions at the local level will be fruitless without a well-coordinated, cross-scale (local to global) ideological shift that puts less priority on economic goals and more on environmental sustainability. These results, and the methodological and theoretical framework applied in this dissertation, thus provide a useful platform for the successful application of future research that specifically addresses mitigation strategies to reduce local-level environmental impacts. This dissertation
Density-functional theory for fluid-solid and solid-solid phase transitions.
Bharadwaj, Atul S; Singh, Yashwant
2017-03-01
We develop a theory to describe solid-solid phase transitions. The density functional formalism of classical statistical mechanics is used to find an exact expression for the difference in the grand thermodynamic potentials of the two coexisting phases. The expression involves both the symmetry conserving and the symmetry broken parts of the direct pair correlation function. The theory is used to calculate phase diagram of systems of soft spheres interacting via inverse power potentials u(r)=ε(σ/r)^{n}, where parameter n measures softness of the potential. We find that for 1/nfcc) structure while for 1/n≥0.154 the body-centred-cubic (bcc) structure is preferred. The bcc structure transforms into the fcc structure upon increasing the density. The calculated phase diagram is in good agreement with the one found from molecular simulations.
Directory of Open Access Journals (Sweden)
Daniel Wong-McSweeney
2016-12-01
Full Text Available The aim of this paper is to determine what non-exposure factors influence the relationship between vibration and noise exposure from the construction of a Light Rapid Transit (LRT system and the annoyance of nearby residents. Noise and vibration from construction sites are known to annoy residents, with annoyance increasing as a function of the magnitude of the vibration and noise. There is not a strong correlation between exposure and levels of annoyance suggesting that factors not directly related to the exposure may have an influence. A range of attitudinal, situational and demographic factors are investigated with the aim of understanding the wide variation in annoyance for a given vibration exposure. A face-to-face survey of residents (n = 350 near three sites of LRT construction was conducted, and responses were compared to semi-empirical estimates of the internal vibration within the buildings. It was found that annoyance responses due to vibration were strongly influenced by two attitudinal variables, concern about property damage and sensitivity to vibration. Age, ownership of the property and the visibility of the construction site were also important factors. Gender, time at home and expectation of future levels of vibration had much less influence. Due to the measurement methods used, it was not possible to separate out the effects of noise and vibration on annoyance; as such, this paper focusses on annoyance due to vibration exposure. This work concludes that for the most cost-effective reduction of the impact of construction vibration and noise on the annoyance felt by a community, policies should consider attitudinal factors.
International Nuclear Information System (INIS)
Oriols, X.
2016-01-01
Exact predictions for most quantum systems are computationally inaccessible. This is the so-called many body problem, which is present in most common interpretations of quantum mechanics. Therefore, predictions of natural quantum phenomena have to rely on some approximations (assumptions or simplifications). In the literature, there are different types of approximations, ranging from those whose justification is basically based on theoretical developments to those whose justification lies on the agreement with experiments. This last type of approximations can convert a quantum theory into an “unfalsifiable” quantum theory, true by construction. On the practical side, converting some part of a quantum theory into an “unfalsifiable” one ensures a successful modeling (i.e. compatible with experiments) for quantum engineering applications. An example of including irreversibility and dissipation in the Bohmian modeling of open systems is presented. On the ontological level, however, the present-day foundational problems related to controversial quantum phenomena have to avoid (if possible) being contaminated by the unfalsifiability originated from the many body problem. An original attempt to show how the Bohmian theory itself (minimizing the role of many body approximations) explains the transitions from a microscopic quantum system towards a macroscopic classical one is presented. (paper)
"Theory Becoming Alive": The Learning Transition Process of Newly Graduated Nurses in Canada.
Nour, Violet; Williams, Anne M
2018-01-01
Background Newly graduated nurses often encounter a gap between theory and practice in clinical settings. Although this has been the focus of considerable research, little is known about the learning transition process. Purpose The purpose of this study was to explore the experiences of newly graduated nurses in acute healthcare settings within Canada. This study was conducted to gain a greater understanding of the experiences and challenges faced by graduates. Methods Grounded theory method was utilized with a sample of 14 registered nurses who were employed in acute-care settings. Data were collected using in-depth interviews. Constant comparative analysis was used to analyze data. Results Findings revealed a core category, "Theory Becoming Alive," and four supporting categories: Entry into Practice, Immersion, Committing, and Evolving. Theory Becoming Alive described the process of new graduate nurses' clinical learning experiences as well as the challenges that they encountered in clinical settings after graduating. Conclusions This research provides a greater understanding of learning process of new graduate nurses in Canada. It highlights the importance of providing supportive environments to assist new graduate nurses to develop confidence as independent registered nurses in clinical areas. Future research directions as well as supportive educational strategies are described.
Ab initio theory of noble gas atoms in bcc transition metals.
Jiang, Chao; Zhang, Yongfeng; Gao, Yipeng; Gan, Jian
2018-06-18
Systematic ab initio calculations based on density functional theory have been performed to gain fundamental understanding of the interactions between noble gas atoms (He, Ne, Ar and Kr) and bcc transition metals in groups 5B (V, Nb and Ta), 6B (Cr, Mo and W) and 8B (Fe). Our charge density analysis indicates that the strong polarization of nearest-neighbor metal atoms by noble gas interstitials is the electronic origin of their high formation energies. Such polarization becomes more significant with an increasing gas atom size and interstitial charge density in the host bcc metal, which explains the similar trend followed by the unrelaxed formation energies of noble gas interstitials. Upon allowing for local relaxation, nearby metal atoms move farther away from gas interstitials in order to decrease polarization, albeit at the expense of increasing the elastic strain energy. Such atomic relaxation is found to play an important role in governing both the energetics and site preference of noble gas atoms in bcc metals. Our most notable finding is that the fully relaxed formation energies of noble gas interstitials are strongly correlated with the elastic shear modulus of the bcc metal, and the physical origin of this unexpected correlation has been elucidated by our theoretical analysis based on the effective-medium theory. The kinetic behavior of noble gas atoms and their interaction with pre-existing vacancies in bcc transition metals have also been discussed in this work.
International Nuclear Information System (INIS)
Garrett, B.C.; Truhlar, D.G.
1979-01-01
Canonical variational transition state theory, microcanonical variational transition state theory, and Miller's unified statistical theory were used in an attempt to correct two major deficiencies of the conventional transition state theory. These are: (1) the necessity of extra assumptions to include quantum mechanical tunneling effects and (2) the fundamental assumption that trajectories crossing a dividing surface in phase space proceed directly to products. The accuracy of these approximate methods were tested by performing calculations for several collinear reactions of hydrogen, deuterium, chlorine, or iodine, with five isotopes of hydrogen molecules and comparison of these results with those from accurate quantitative calculations of the reaction probabilities as functions of energy and of the thermal rate constants as functions of temperature. 49 references, 28 figures, 17 tables
Directory of Open Access Journals (Sweden)
Simona MĂLĂESCU
2008-05-01
Full Text Available In the transition period, the Sub-Carpathians between Olt and Jiu were characterised by a reduced growth of the demographic potential, but especialy by a large mobility due to the socio-economical development and the balance between the rural and urban environment. From a spatial perspective, the Northern frame has reduced its demographic potential in the last 17 years, even more than the rural dorsal between the two bordering cities. Overall, the two extremities have increased their demographic potential, even if the evolutional tendencies have changed along the 17 years.The „centrality” degree and the vicinity of the capital and of the E 70 highway, determine, in the case of Râmnicu Vâlcea, a much higher territorial demographic “binding capacity”. Although still within the upper echelons from the perspective of the socio-economical development indicators, and moreover from that of the demographic resource descriptors (alphabetization indices, etc., the studied perimeter is in a constant demographic potential reduction process (proportionally the same with the distance towards the bordering urban center, firstly of the young one (atracted by the two urbane centers and secondly of the young and qualified –in general (rural and urban –in the benefit of the country’s main urban centers and especially the capital.
Phase transition in a quark-gluon plasma and hydrodynamic theory
International Nuclear Information System (INIS)
Chernavskaya, O.D.; Chernavskij, D.S.
1988-01-01
A wide range of problem concerning the phase transition of a quark-gluon plasma to the hadron matter is considered in connection with the hardronization problem within the frame of the hydrodynamical theory of ultra-relativistic collisions. A short review of the present hadron models and possible mechanisms of thermalization is given. The character of the phase transition within the bag model is analysed, effects of the surface interaction result in a nontrivial character of the phase transition: the metastable states of matter become possible. The review of the possible scenaria of hadronization of the cooling hydrodynamical matter is given, the choice between them is determined by a kinetic analysis. The systems with the energy density near the critical point (∼ 4 GeV/Fm 3 ) are shown to be hadronized by the mechanism based on a strong plasma supercooling (with a considerable transverse momentum increase). The traditional hadronization mechanism (mixed phase) is preferable for more hot systems. Theoretical estimations are compared with the JACEE (cosmic rays) data
Characterization of Phase Transition in Heisenberg Fluids from Density Functional Theory
International Nuclear Information System (INIS)
Li Liangsheng; Li Li; Chen Xiaosong
2009-01-01
The phase transition of Heisenberg fluid has been investigated with the density functional theory in mean-field approximation (MF). The matrix of the second derivatives of the grand canonical potential Ω with respect to the particle density fluctuations and the magnetization fluctuations has been investigated and diagonalized. The smallest eigenvalue being 0 signalizes the phase instability and the related eigenvector characterizes this phase transition. We find a Curie line where the order parameter is pure magnetization and a spinodal where the order parameter is a mixture of particle density and magnetization. Along the spinodal, the character of phase instability changes continuously from predominant condensation to predominant ferromagnetic phase transition with the decrease of total density. The spinodal meets the Curie line at the critical endpoint with the reduced density ρ* = ρσ 3 = 0.224 and the reduced temperature T* = kT/ element of = 1.87 (σ is the diameter of Heisenberg hard sphere and element of is the coupling constant).
International Nuclear Information System (INIS)
Ertas, Mehmet; Keskin, Mustafa; Deviren, Bayram
2010-01-01
The dynamic phase transitions are studied in the spin-2 Ising model under a time-dependent oscillating magnetic field by using the effective-field theory with correlations. The effective-field dynamic equation is derived by employing the Glauber transition rates and the phases in the system are obtained by solving this dynamic equation. The nature (first- or second-order) of the dynamic phase transition is characterized by investigating the thermal behavior of the dynamic order parameter and the dynamic phase transition temperatures are obtained. The dynamic phase diagrams are presented in (T/zJ, h/zJ) plane.
de La Sierra, Ruben Ulises
The present study introduces entropy mapping as a comprehensive method to analyze and describe complex interactive systems; and to assess the effect that entropy has in paradigm changes as described by transition theory. Dynamics of interactions among environmental, economic and demographic conditions affect a number of fast growing locations throughout the world. One of the regions especially affected by accelerated growth in terms of demographic and economic development is the border region between Mexico and the US. As the contrast between these countries provides a significant economic and cultural differential, the dynamics of capital, goods, services and people and the rates at which they interact are rather unique. To illustrate the most fundamental economic and political changes affecting the region, a background addressing the causes for these changes leading to the North America Free Trade Agreement (NAFTA) is presented. Although the concept of thermodynamic entropy was first observed in physical sciences, a relevant homology exists in biological, social and economic sciences as the universal tendency towards disorder, dissipation and equilibrium is present in these disciplines when energy or resources become deficient. Furthermore, information theory is expressed as uncertainty and randomness in terms of efficiency in transmission of information. Although entropy in closed systems is unavoidable, its increase in open systems, can be arrested by a flux of energy, resources and/or information. A critical component of all systems is the boundary. If a boundary is impermeable, it will prevent energy flow from the environment into the system; likewise, if the boundary is too porous, it will not be able to prevent the dissipation of energy and resources into the environment, and will not prevent entropy from entering. Therefore, two expressions of entropy--thermodynamic and information--are identified and related to systems in transition and to spatial
International Nuclear Information System (INIS)
Balzer, Matthias
2008-01-01
The central goal of this thesis is the examination of strongly correlated electron systems on the basis of the two-dimensional Hubbard model. We analyze how the properties of the Mott insulator change upon doping and with interaction strength. The numerical evaluation is done using quantum cluster approximations, which allow for a thermodynamically consistent description of the ground state properties. The framework of self-energy-functional theory offers great flexibility for the construction of cluster approximations. A detailed analysis sheds light on the quality and the convergence properties of different cluster approximations within the self-energy-functional theory. We use the one-dimensional Hubbard model for these examinations and compare our results with the exact solution. In two dimensions the ground state of the particle-hole symmetric model at half-filling is an antiferromagnetic insulator, independent of the interaction strength. The inclusion of short-range spatial correlations by our cluster approach leads to a considerable improvement of the antiferromagnetic order parameter as compared to dynamical mean-field theory. In the paramagnetic phase we furthermore observe a metal-insulator transition as a function of the interaction strength, which qualitatively differs from the pure mean-field scenario. Starting from the antiferromagnetic Mott insulator a filling-controlled metal-insulator transition in a paramagnetic metallic phase can be observed. Depending on the cluster approximation used an antiferromagnetic metallic phase may occur at first. In addition to long-range antiferromagnetic order, we also considered superconductivity in our calculations. The superconducting order parameter as a function of doping is in good agreement with other numerical methods, as well as with experimental results. (orig.)
International Nuclear Information System (INIS)
Vetter, B.M.
1991-01-01
This paper reports on changing population demographics, poor academic preparation for and a decreasing interest in engineering among college students which indicates possible shortages ahead, particularly among chemical and petroleum engineers. The talent pool for engineering must be enlarged to include women and minority men, if we are to ensure an adequate future supply for the U.S
Can quantum transition state theory be defined as an exact t = 0+ limit?
Jang, Seogjoo; Voth, Gregory A.
2016-02-01
The definition of the classical transition state theory (TST) as a t → 0+ limit of the flux-side time correlation function relies on the assumption that simultaneous measurement of population and flux is a well defined physical process. However, the noncommutativity of the two measurements in quantum mechanics makes the extension of such a concept to the quantum regime impossible. For this reason, quantum TST (QTST) has been generally accepted as any kind of quantum rate theory reproducing the TST in the classical limit, and there has been a broad consensus that no unique QTST retaining all the properties of TST can be defined. Contrary to this widely held view, Hele and Althorpe (HA) [J. Chem. Phys. 138, 084108 (2013)] recently suggested that a true QTST can be defined as the exact t → 0+ limit of a certain kind of quantum flux-side time correlation function and that it is equivalent to the ring polymer molecular dynamics (RPMD) TST. This work seeks to question and clarify certain assumptions underlying these suggestions and their implications. First, the time correlation function used by HA as a starting expression is not related to the kinetic rate constant by virtue of linear response theory, which is the first important step in relating a t = 0+ limit to a physically measurable rate. Second, a theoretical analysis calls into question a key step in HA's proof which appears not to rely on an exact quantum mechanical identity. The correction of this makes the true t = 0+ limit of HA's QTST different from the RPMD-TST rate expression, but rather equal to the well-known path integral quantum transition state theory rate expression for the case of centroid dividing surface. An alternative quantum rate expression is then formulated starting from the linear response theory and by applying a recently developed formalism of real time dynamics of imaginary time path integrals [S. Jang, A. V. Sinitskiy, and G. A. Voth, J. Chem. Phys. 140, 154103 (2014)]. It is shown
Energy Technology Data Exchange (ETDEWEB)
Jain, Amber; Subotnik, Joseph E., E-mail: subotnik@sas.upenn.edu [Department of Chemistry, University of Pennsylvania, 231 South 34th Street, Philadelphia, Pennsylvania 19104 (United States)
2015-10-07
We investigate a simple approach to compute a non-adiabatic thermal rate constant using the fewest switches surface hopping (FSSH) dynamics. We study the effects of both decoherence (using our augmented-FSSH (A-FSSH) algorithm) and forbidden hops over a large range of parameters, including high and low friction regimes, and weak and strong electronic coupling regimes. Furthermore, when possible, we benchmark our results against exact hierarchy equations of motion results, where we usually find a maximum error of roughly a factor of two (at reasonably large temperatures). In agreement with Hammes-Schiffer and Tully, we find that a merger of transition state theory and surface hopping can be both accurate and efficient when performed correctly. We further show that detailed balance is followed approximately by A-FSSH dynamics.
Consumer-resource theory predicts dynamic transitions between outcomes of interspecific interactions
Holland, J. Nathaniel; DeAngelis, Donald L.
2009-01-01
Interactions between two populations are often defined by their interaction outcomes; that is, the positive, neutral, or negative effects of species on one another. Yet, signs of outcomes are not absolute, but vary with the biotic and abiotic contexts of interactions. Here, we develop a general theory for transitions between outcomes based on consumer-resource (C-R) interactions in which one or both species exploit the other as a resource. Simple models of C-R interactions revealed multiple equilibria, including one for species coexistence and others for extinction of one or both species, indicating that species densities alone could determine the fate of interactions. All possible outcomes (+ +), (+ -), (- -), (+ 0), (- 0), (0 0) of species coexistence emerged merely through changes in parameter values of C-R interactions, indicating that variation in C-R interactions resulting from biotic and abiotic conditions could determine shifts in outcomes. These results suggest that C-R interactions can provide a broad mechanism for understanding context- and density-dependent transitions between interaction outcomes.
CPA theory of the magnetization in rare earth transition metal alloys
International Nuclear Information System (INIS)
Szpunar, B.; Lindgaard, P.A.
1976-11-01
Calculations were made of the magnetic moment per atom of the transition metal and the rare earth metal in the intermetallic compounds, Gdsub(1-x)Nisub(x), Gdsub(1-x)Fesub(x), Gdsub(1-x)Cosub(x), and Ysub(1-x)Cosub(x). A simple model of the disordered alloy consisting of spins localized on the rare earth atoms and interacting with a narrow d-band is considered. The magnetic moment of the alloy at zero temperature is calculated within the molecular field and Hartree-Fock approximations. Disorder is treated in the coherent potential approximation. Results are in good agreement with the experimental data obtained for the crystalline and amorphous intermetallic compounds. It is shown that the temperature dependence of the magnetic moments and Curie and ferrimagnetic compensation temperatures can be accounted for by a simple model assuming a RKKY interaction between the rare-earth moments and the transition metal pseudo spin. The interaction is mediated by an effective alloy medium calculated using the CPA theory and elliptic densities of states. (Auth.)
International Nuclear Information System (INIS)
Rosciszewski, K.
1979-01-01
The phase transitions between liquids and several of the simplest liquid crystalline phases (nematic, cholesteric, and the simplest types of smectic A and smectic C) were studied from the point of view of the group-theoretical arguments of Landau theory. It was shown that the only possible candidates for second-order phase transitions are those between nematic and smectic A, between centrosymmetric nematic and smectic C and between centrosymmetric smectic A and smectic C. Simple types of density functions for liquid crystalline phases are proposed. (author)
Energy Technology Data Exchange (ETDEWEB)
Greene, Samuel M., E-mail: samuel.greene@chem.ox.ac.uk; Shan, Xiao, E-mail: xiao.shan@chem.ox.ac.uk; Clary, David C., E-mail: david.clary@chem.ox.ac.u [Physical and Theoretical Chemistry Laboratory, Department of Chemistry, University of Oxford, South Parks Road, Oxford OX1 3QZ (United Kingdom)
2016-06-28
Semiclassical Transition State Theory (SCTST), a method for calculating rate constants of chemical reactions, offers gains in computational efficiency relative to more accurate quantum scattering methods. In full-dimensional (FD) SCTST, reaction probabilities are calculated from third and fourth potential derivatives along all vibrational degrees of freedom. However, the computational cost of FD SCTST scales unfavorably with system size, which prohibits its application to larger systems. In this study, the accuracy and efficiency of 1-D SCTST, in which only third and fourth derivatives along the reaction mode are used, are investigated in comparison to those of FD SCTST. Potential derivatives are obtained from numerical ab initio Hessian matrix calculations at the MP2/cc-pVTZ level of theory, and Richardson extrapolation is applied to improve the accuracy of these derivatives. Reaction barriers are calculated at the CCSD(T)/cc-pVTZ level. Results from FD SCTST agree with results from previous theoretical and experimental studies when Richardson extrapolation is applied. Results from our implementation of 1-D SCTST, which uses only 4 single-point MP2/cc-pVTZ energy calculations in addition to those for conventional TST, agree with FD results to within a factor of 5 at 250 K. This degree of agreement and the efficiency of the 1-D method suggest its potential as a means of approximating rate constants for systems too large for existing quantum scattering methods.
Theory of Temperature Dependence of the Magnetization in Rare-Earth-Transition-Metal Alloys
DEFF Research Database (Denmark)
Szpunar, B.; Lindgård, Per-Anker
1977-01-01
-spin. The interaction is mediated by an effective alloy medium calculated using the CPA theory and elliptic densities of states. Es wird gezeigt, daß die Temperaturabhängigkeit der magnetischen Momente und die Curie-Temperatur sowie die Temperatur der ferrimagnetischen Kompensation für Gd1-xTx (T = Co, Ni und Fe) und Y......1-xCox durch ein einfaches Model1 erklärt werden können, das eine RKKY-Wechsel-wirkung zwischen den Momenten der Seltenen Erden und des Pseudo-Spins des Übergangsmetalls annimmt. Die Wechselwirkung wird durch ein effektives Legierungsmedium übermittelt, das mit der CPA-Theorie und elliptischen......It is shown that the temperature dependence of the magnetic moments and Curie and ferrimagnetic compensation temperatures for Gdl-xTx (T = Co, Ni, and Fe) and Y1-xCox can be accounted for by a simple model assuming a RKKY interaction between the rare-earth moments and the transition-metal pseudo...
International Nuclear Information System (INIS)
Singh, Ram Chandra
2007-01-01
We have used the density-functional theory to study the effect of varying temperature on the isotropic-nematic transition of a fluid of molecules interacting via the Gay-Berne intermolecular potential. The nematic phase is found to be stable with respect to isotropic phase in the temperature range 0.80≤T*≤1.25. Pair correlation functions needed as input information in density-functional theory is calculated using the Percus-Yevick integral equation theory. We find that the density-functional theory is good for studying the isotropic-nematic transition in molecular fluids if the values of the pair-correlation functions in the isotropic phase are known accurately. We have also compared our results with computer simulation results wherever they are available
Phase transitions and flux distributions of SU(2) lattice gauge theory
International Nuclear Information System (INIS)
Peng, Yingcai.
1993-01-01
The strong interactions between quarks are believed to be described by Quantum Chromodynamics (QCD), which is a non-abelian SU(3) gauge theory. It is known that QCD undergoes a deconfining phase transition at very high temperatures, that is, at low temperatures QCD is in confined phase, at sufficient high temperatures it is in an unconfined phase. Also, quark confinement is believed to be due to string formation. In this dissertation the authors studied SU(2) gauge theory using numerical methods of LGT, which will provide some insights about the properties of QCD because SU(2) is similar to SU(3). They measured the flux distributions of a q bar q pair at various temperatures in different volumes. They find that in the limit of infinite volumes the flux distribution is different in the two phases. In the confined phase strong evidence is found for the string formation, however, in the unconfined phase there is no string formation. On the other hand, in the limit of zero temperature and finite volumes they find a clear signal for string formation in the large volume region, however, the string tension measured in intermediate volumes is due to finite volume effects, there is no intrinsic string formation. The color flux energies (action) of the q bar q pair are described by Michael sum rules. The original Michael sum rules deal with a static q bar q pair at zero temperature in infinite volumes. To check these sum rules with flux data at finite temperatures, they present a complete derivation for the sum rules, thus generalizing them to account for finite temperature effects. They find that the flux data are consistent with the prediction of generalized sum rules. The study elucidates the rich structures of QCD, and provides evidence for quark confinement and string formation. This supports the belief that QCD is a correct theory for strong interactions, and quark confinement can be explained by QCD
2013-01-01
Background Under the National Rural Health Mission, the current emphasis is on achieving universal institutional births through incentive schemes as part of reforms related to childbirth in India. There has been rapid progress in achieving this goal. To understand the choices made as well as practices and perceptions related to childbirth amongst tribal women in Gujarat and how these have been influenced by modernity in general and modernity brought in through maternal health policies. Method A model depicting the transition in childbirth practices amongst tribal women was constructed using the grounded theory approach with; 8 focus groups of women, 5 in depth interviews with traditional birth attendants, women, and service providers and field notes on informal discussions and observations. Results A transition in childbirth practices across generations was noted, i.e. a shift from home births attended by Traditional Birth Attendants (TBAs) to hospital births. The women and their families both adapted to and shaped this transition through a constant ’trade-off between desirable and essential’- the desirable being a traditional homebirth in secure surroundings and the essential being the survival of mother and baby by going to hospital. This transition was shaped by complex multiple factors: 1) Overall economic growth and access to modern medical care influencing women’s choices, 2) External context in terms of the international maternal health discourses and national policies, especially incentive schemes for promoting institutional deliveries, 3) Socialisation into medical childbirth practices, through exposure to many years of free outreach services for maternal and child health, 4) Loss of self reliance in the community as a consequence of role redefinition and deskilling of the TBAs and 5) Cultural belief that intervention is necessary during childbirth aiding easy acceptance of medical interventions. Conclusion In resource poor settings where choices are
Indian Academy of Sciences (India)
First page Back Continue Last page Overview Graphics. TRANSIT. SYSTEM: DETERMINE 2D-POSITION GLOBALLY BUT INTERMITTENT (POST-FACTO). IMPROVED ACCURACY. PRINCIPLE: POLAR SATELLITES WITH INNOVATIONS OF: GRAVITY-GRADIENT ATTITUDE CONTROL; DRAG COMPENSATION. WORKS ...
Direct simulation of groundwater transit-time distributions using the reservoir theory
Etcheverry, David; Perrochet, Pierre
Groundwater transit times are of interest for the management of water resources, assessment of pollution from non-point sources, and quantitative dating of groundwaters by the use of environmental isotopes. The age of water is the time water has spent in an aquifer since it has entered the system, whereas the transit time is the age of water as it exits the system. Water at the outlet of an aquifer is a mixture of water elements with different transit times, as a consequence of the different flow-line lengths. In this paper, transit-time distributions are calculated by coupling two existing methods, the reservoir theory and a recent age-simulation method. Based on the derivation of the cumulative age distribution over the whole domain, the approach accounts for the whole hydrogeological framework. The method is tested using an analytical example and its applicability illustrated for a regional layered aquifer. Results show the asymmetry and multimodality of the transit-time distribution even in advection-only conditions, due to the aquifer geometry and to the velocity-field heterogeneity. Résumé Les temps de transit des eaux souterraines sont intéressants à connaître pour gérer l'évaluation des ressources en eau dans le cas de pollution à partir de sources non ponctuelles, et aussi pour dater quantitativement les eaux souterraines au moyen des isotopes du milieu. L'âge de l'eau est le temps qu'elle a passé dans un aquifère depuis qu'elle est entrée dans le système, alors que le temps de transit est l'âge de l'eau au moment où elle quitte le système. L'eau à la sortie d'un aquifère est un mélange d'eaux possédant différents temps de transit, du fait des longueurs différentes des lignes de courant suivies. Dans ce papier, les distributions des temps de transit sont calculées en couplant deux méthodes, la théorie du réservoir et une méthode récente de simulation des âges. Basée sur la dérivation de la distribution cumulées des âges sur
Hirschi, Andreas
2010-01-01
Chance events are considered important in career development, yet little empirical research is available on their predictors and consequences. The present study investigated socio-demographic (gender, nationality, school-type), personality (openness, locus of control) and career development variables (career decidedness, career planning) in…
Directory of Open Access Journals (Sweden)
J.E. García-Ramos
2014-09-01
Full Text Available We introduce the basic concepts of catastrophe theory needed to derive analytically the phase diagram of the proton–neutron interacting boson model (IBM-2. Previous studies [1–3] were based on numerical solutions. We here explain the whole IBM-2 phase diagram including the precise order of the phase transitions in terms of the cusp catastrophe.
DEFF Research Database (Denmark)
Hummelshøj, Jens Strabo; Landis, David; Voss, Johannes
2009-01-01
We present a computational screening study of ternary metal borohydrides for reversible hydrogen storage based on density functional theory. We investigate the stability and decomposition of alloys containing 1 alkali metal atom, Li, Na, or K (M1); and 1 alkali, alkaline earth or 3d/4d transition...
A Definition of the Magnetic Transition Temperature Using Valence Bond Theory.
Jornet-Somoza, Joaquim; Deumal, Mercè; Borge, Juan; Robb, Michael A
2018-03-01
Macroscopic magnetic properties are analyzed using Valence Bond theory. Commonly the critical temperature T C for magnetic systems is associated with a maximum in the energy-based heat capacity C p (T). Here a more broadly applicable definition of the magnetic transition temperature T C is described using the spin moment expectation value (i.e., applying the spin exchange density operator) instead of energy. Namely, the magnetic capacity C s (T) reflects variation in the spin multiplicity as a function of temperature, which is shown to be related to ∂[χT(T)]/∂T. Magnetic capacity C s (T) depends on long-range spin interactions that are not relevant in the energy-based heat capacity C p (T). Differences between C s (T) and C p (T) are shown to be due to spin order/disorder within the crystal that can be monitored via a Valence Bond analysis of the corresponding magnetic wave function. Indeed the concept of the Boltzmann spin-alignment order is used to provide information about the spin correlation between magnetic units. As a final illustration, the critical temperature is derived from the magnetic capacity for several molecular magnets presenting different magnetic topologies that have been experimentally studied. A systematic shift between the transition temperatures associated with C s (T) and C p (T) is observed. It is demonstrated that this shift can be attributed to the loss of long-range spin correlation. This suggests that the magnetic capacity C s (T) can be used as a predictive tool for the magnetic topology and thus for the synthetic chemists.
Phase transitions of titanite CaTiSiO5 from density functional perturbation theory
Malcherek, Thomas; Fischer, Michael
2018-02-01
Phonon dispersion of titanite CaTiSiO5 has been calculated using the variational density functional perturbation theory. The experimentally known out-of-center distortion of the Ti atom is confirmed. The distortion is associated with a Bu mode that is unstable for wave vectors normal to the octahedral chain direction of the C 2 /c aristotype structure. The layer of wave vectors with imaginary mode frequencies also comprises the Brillouin zone boundary point Y (0 ,1 ,0 ) , which is critical for the transition to the P 21/c ground-state structure. The phonon branch equivalent to the imaginary branch of the titanite aristotype is found to be stable in malayaite CaSnSiO5. The unstable phonon mode in titanite leads to the formation of transoriented short and long Ti-O1 bonds. The Ti as well as the connecting O1 atom exhibit strongly anomalous Born effective charges along the octahedral chain direction [001], indicative of the strong covalency in this direction. Accordingly and in contrast to malayaite, LO-TO splitting is very large in titanite. In the C 2 /c phase of titanite, the Ti-O1-Ti distortion chain is disordered with respect to neighboring distortion chains, as all chain configurations are equally unstable along the phonon branch. This result is in agreement with diffuse x-ray scattering in layers normal to the chain direction that is observed at temperatures close to the P 21/c to C 2 /c transition temperature and above. The resulting dynamic chains of correlated Ti displacements are expected to order in two dimensions to yield the P 21/c ground-state structure of titanite.
Narumi, Takayuki; Tokuyama, Michio
2017-03-01
For short-range attractive colloids, the phase diagram of the kinetic glass transition is studied by time-convolutionless mode-coupling theory (TMCT). Using numerical calculations, TMCT is shown to recover all the remarkable features predicted by the mode-coupling theory for attractive colloids: the glass-liquid-glass reentrant, the glass-glass transition, and the higher-order singularities. It is also demonstrated through the comparisons with the results of molecular dynamics for the binary attractive colloids that TMCT improves the critical values of the volume fraction. In addition, a schematic model of three control parameters is investigated analytically. It is thus confirmed that TMCT can describe the glass-glass transition and higher-order singularities even in such a schematic model.
Comparison of a low- to high-confinement transition theory with experimental data from DIII-D.
Guzdar, P N; Kleva, R G; Groebner, R J; Gohil, P
2002-12-23
From our recent theory based on the generation of shear flow and field in finite beta plasmas, the criterion for bifurcation from low to high confinement mode yields a critical parameter proportional to T(e)/square root (L(n)), where T(e) is the electron temperature and L(n) is the density scale length. The predicted threshold shows very good agreement with edge measurements on discharges undergoing low-to-high transitions in DIII-D. The observed differences in the transitions with the reversal of the toroidal magnetic field are reconciled in terms of this critical parameter. The theory also provides an explanation for pellet injection H modes in DIII-D, thereby unifying unconnected methods for accomplishing the transition.
The Theory of Dynamic Public Transit Priority with Dynamic Stochastic Park and Ride
Zhu, Chengming; Chen, Yanyan; Ma, Changxi
2014-01-01
Public transit priority is very important for relieving traffic congestion. The connotation of dynamic public transit priority and dynamic stochastic park and ride is presented. Based on the point that the travel cost of public transit is not higher than the travel cost of car, how to determine the level of dynamic public transit priority is discussed. The traffic organization method of dynamic public transit priority is introduced. For dynamic stochastic park and ride, layout principle, scal...
Uni-directional consumer-resource theory characterizing transitions of interaction outcomes
Wang, Y.; DeAngelis, D.L.; Holland, J.N.
2011-01-01
A resource is considered here to be a biotic population that helps to maintain the population growth of its consumers, whereas a consumer utilizes a resource and in turn decreases its growth rate. Bi-directional consumer-resource (C-R) interactions have been the object of recent theory. In these interactions, each species acts, in some respects, as both a consumer and a resource of the other, which is the basis of many mutualisms. In uni-directional C-R interactions between two species, one acts as a consumer and the other as a material and/or energy resource, while neither acts as both. The relationship between insect pollinator/seed parasites and the host plant is an example of the latter interaction type of C-R, as the insect provides no material resource to the plant (though it provides a pollination service). In this paper we consider a different variation of the uni-directional C-R interaction, in which the resource species has both positive and negative effects on the consumer species, while the consumer has only a negative effect on the resource. A predator-prey system in which the prey is able to kill or consume predator eggs or larvae is an example. Our aim is to demonstrate mechanisms by which interaction outcomes of this system vary with different conditions, and thus to extend the uni-directional C-R theory established by Holland and DeAngelis (2009). By the analysis of a specific two-species system, it is shown that there is no periodic solution of the system, and the parameter (factor) space can be divided into six regions, which correspond to predation/parasitism, amensalism, and competition. The interaction outcomes of the system transition smoothly when the parameters are changed continuously in the six regions and/or initial densities of the species vary in a smooth fashion. Varying a pair of parameters can also result in the transitions. The analysis leads to both conditions under which the species approach their maximal densities, and
Bao, Junwei Lucas; Zhang, Xin
2016-01-01
Bond dissociation is a fundamental chemical reaction, and the first principles modeling of the kinetics of dissociation reactions with a monotonically increasing potential energy along the dissociation coordinate presents a challenge not only for modern electronic structure methods but also for kinetics theory. In this work, we use multifaceted variable-reaction-coordinate variational transition-state theory (VRC-VTST) to compute the high-pressure limit dissociation rate constant of tetrafluoroethylene (C2F4), in which the potential energies are computed by direct dynamics with the M08-HX exchange correlation functional. To treat the pressure dependence of the unimolecular rate constants, we use the recently developed system-specific quantum Rice–Ramsperger–Kassel theory. The calculations are carried out by direct dynamics using an exchange correlation functional validated against calculations that go beyond coupled-cluster theory with single, double, and triple excitations. Our computed dissociation rate constants agree well with the recent experimental measurements. PMID:27834727
Laporte, Pauline; Vonarx, Nicolas
2016-06-01
Accompanying a dying person up to and at the actual moment of death is a duty that often leaves carers at a loss. We shall show how far theoretical nursing knowledge can help practitioners who accompany the end of life by applying two theories of care : Reed’s theory of self-transcendence and Meleis’s theory of transition. Our interpretation of the theory of self-transcendence designates three points of reference in the concept of dying well. The first relates to the overtures prompted by the vulnerability that the context of dying inspires. The second concerns the capacity of the patient to summon up intrapersonal, interpersonal and transpersonal strategies, and the third considers the benefits when self-transcendence is achieved. The theory of transition similarly presents three points of reference. The first is based on informing the patient about palliative care and telling him or her the truth about the prognosis. The second relates to coordinating the interprofessional team that is looking after the dying person. The last criterion is that the palliative care should be started at a suitable moment. This makes it possible to educate a patient who wishes to die at home and thus create an environment favourable to the transition.
Greene, Samuel M; Shan, Xiao; Clary, David C
2016-02-28
We investigate which terms in Reduced-Dimensionality Semiclassical Transition State Theory (RD SCTST) contribute most significantly in rate constant calculations of hydrogen extraction and exchange reactions of hydrocarbons. We also investigate the importance of deep tunneling corrections to the theory. In addition, we introduce a novel formulation of the theory in Jacobi coordinates. For the reactions of H atoms with methane, ethane, and cyclopropane, we find that a one-dimensional (1-D) version of the theory without deep tunneling corrections compares well with 2-D SCTST results and accurate quantum scattering results. For the "heavy-light-heavy" H atom exchange reaction between CH3 and CH4, deep tunneling corrections are needed to yield 1-D results that compare well with 2-D results. The finding that accurate rate constants can be obtained from derivatives of the potential along only one dimension further validates RD SCTST as a computationally efficient yet accurate rate constant theory.
Theory of high-T sub c superconductivity based on the fermion-condensation quantum phase transition
Amusia, M Ya; Shaginyan, V R
2001-01-01
A theory of high temperature superconductivity based on the combination of the fermion-condensation quantum phase transition and the conventional theory of superconductivity is presented. This theory describes maximum values of the superconducting gap which can be as big as DELTA sub 1 approx 0.1 epsilon sub F , with epsilon sub F being the Fermi level. It is shown that the critical temperature 2T sub c approx = DELTA sub 1. If there exists the pseudogap above T sub c then 2T* approx = DELTA sub 1 , and T* is the temperature at which the pseudogap vanished. A discontinuity in the specific heat at T sub c is calculated. The transition from conventional superconductors to high-T sub c ones as a function of the doping level is investigated
Is there a Demographic Time-bomb?
DEFF Research Database (Denmark)
Greve, Bent
2006-01-01
The article discuss whether the demographic transition in Europe will have any impact on the future of the European welfare states......The article discuss whether the demographic transition in Europe will have any impact on the future of the European welfare states...
Kurchan, Jorge; Parisi, Giorgio; Urbani, Pierfrancesco; Zamponi, Francesco
2013-10-24
We consider the theory of the glass phase and jamming of hard spheres in the large space dimension limit. Building upon the exact expression for the free-energy functional obtained previously, we find that the random first order transition (RFOT) scenario is realized here with two thermodynamic transitions: the usual Kauzmann point associated with entropy crisis and a further transition at higher pressures in which a glassy structure of microstates is developed within each amorphous state. This kind of glass-glass transition into a phase dominating the higher densities was described years ago by Elisabeth Gardner, and may well be a generic feature of RFOT. Microstates that are small excitations of an amorphous matrix-separated by low entropic or energetic barriers-thus emerge naturally, and modify the high pressure (or low temperature) limit of the thermodynamic functions.
A harmonic transition state theory model for defect initiation in crystals
International Nuclear Information System (INIS)
Delph, T J; Cao, P; Park, H S; Zimmerman, J A
2013-01-01
We outline here a model for the initiation of defects in crystals based upon harmonic transition state theory (hTST). This model combines a previously developed model for zero-temperature defect initiation with a multi-dimensional hTST model that is capable of accurately predicting the effects of temperature and loading rate upon defect initiation. The model has several features that set it apart from previous efforts along these lines, most notably a straightforward method of determining the energy barrier between adjacent equilibrium states that does not depend upon a priori information concerning the nature of the defect. We apply the model to two examples, triaxial stretching of a perfect fcc crystal and nanoindentation of a gold substrate. Very good agreement is found between the predictions of the model and independent molecular dynamics (MD) simulations. Among other things, the model predicts a strong dependence of the defect initiation behavior upon the loading parameter. A very attractive feature of this model is that it is valid for arbitrarily slow loading rates, in particular loading rates achievable in the laboratory, and suffers from none of the limitations in this regard inherent in MD simulations. (paper)
Reformulation of time-convolutionless mode-coupling theory near the glass transition
Tokuyama, Michio
2017-10-01
The time-convolutionless mode-coupling theory (TMCT) recently proposed is reformulated under the condition that one of two approximations, which have been used to formulate the original TMCT in addition to the MCT approximations done on a derivation of nonlinear memory function in terms of the intermediate-scattering function, is not employed because it causes unphysical results for intermediate times. The improved TMCT equation is then derived consistently under another approximation. It is first checked that the ergodic to non-ergodic transition obtained by a new equation is exactly the same as that obtained by an old one because the long-time dynamics of both equations coincides with each other. However, it is emphasized that a difference between them appears in the intermediate-time dynamics of physical quantities. Such a difference is explored numerically in the dynamics of a non-Gaussian parameter by employing the Percus-Yevick static structure factor to calculate the nonlinear memory function.
Random matrix theory of the energy-level statistics of disordered systems at the Anderson transition
Energy Technology Data Exchange (ETDEWEB)
Canali, C M
1995-09-01
We consider a family of random matrix ensembles (RME) invariant under similarity transformations and described by the probability density P(H) exp[-TrV(H)]. Dyson`s mean field theory (MFT) of the corresponding plasma model of eigenvalues is generalized to the case of weak confining potential, V(is an element of) {approx} A/2 ln{sup 2}(is an element of). The eigenvalue statistics derived from MFT are shown to deviate substantially from the classical Wigner-Dyson statistics when A < 1. By performing systematic Monte Carlo simulations on the plasma model, we compute all the relevant statistical properties of the RME with weak confinement. For A{sub c} approx. 0.4 the distribution function of the level spacings (LSDF) coincides in a large energy window with the energy LSDF of the three dimensional Anderson model at the metal-insulator transition. For the same A = A{sub c}, the RME eigenvalue-number variance is linear and its slope is equal to 0.32 {+-} 0.02, which is consistent with the value found for the Anderson model at the critical point. (author). 51 refs, 10 figs.
Random matrix theory of the energy-level statistics of disordered systems at the Anderson transition
International Nuclear Information System (INIS)
Canali, C.M.
1995-09-01
We consider a family of random matrix ensembles (RME) invariant under similarity transformations and described by the probability density P(H) exp[-TrV(H)]. Dyson's mean field theory (MFT) of the corresponding plasma model of eigenvalues is generalized to the case of weak confining potential, V(is an element of) ∼ A/2 ln 2 (is an element of). The eigenvalue statistics derived from MFT are shown to deviate substantially from the classical Wigner-Dyson statistics when A c approx. 0.4 the distribution function of the level spacings (LSDF) coincides in a large energy window with the energy LSDF of the three dimensional Anderson model at the metal-insulator transition. For the same A = A c , the RME eigenvalue-number variance is linear and its slope is equal to 0.32 ± 0.02, which is consistent with the value found for the Anderson model at the critical point. (author). 51 refs, 10 figs
The Theory of Dynamic Public Transit Priority with Dynamic Stochastic Park and Ride
Directory of Open Access Journals (Sweden)
Chengming Zhu
2014-01-01
Full Text Available Public transit priority is very important for relieving traffic congestion. The connotation of dynamic public transit priority and dynamic stochastic park and ride is presented. Based on the point that the travel cost of public transit is not higher than the travel cost of car, how to determine the level of dynamic public transit priority is discussed. The traffic organization method of dynamic public transit priority is introduced. For dynamic stochastic park and ride, layout principle, scale, and charging standard are discussed. Traveler acceptability is high through the analysis of questionnaire survey. Dynamic public transit priority with dynamic stochastic park and ride has application feasibility.
ω→π0γ* and ϕ→π0γ* transition form factors in dispersion theory
Schneider, Sebastian P.; Kubis, Bastian; Niecknig, Franz
2012-09-01
We calculate the ω→π0γ* and ϕ→π0γ* electromagnetic transition form factors based on dispersion theory, relying solely on a previous dispersive analysis of the corresponding three-pion decays and the pion vector form factor. We compare our findings to recent measurements of the ω→π0μ+μ- decay spectrum by the NA60 collaboration, and strongly encourage experimental investigation of the Okubo-Zweig-Iizuka forbidden ϕ→π0ℓ+ℓ- decays in order to understand the strong deviations from vector-meson dominance found in these transition form factors.
International Nuclear Information System (INIS)
Christensen, J.; Damgaard, P.H.
1991-01-01
The finite-temperature deconfinement phase transition of SU(2) lattice gauge theory in (2+1) dimensions is studied by Monte Carlo methods. Comparison is made with the expected form of correlation functions on both sides of the critical point. The critical behavior is compared with expectations based on universality arguments. Attempts are made to extract unbiased values of critical exponents on several lattices sizes. The behavior of Polyakov loops in higher representations of the gauge group is studied close to the phase transition. (orig.)
Complex Network Theory Applied to the Growth of Kuala Lumpur's Public Urban Rail Transit Network.
Directory of Open Access Journals (Sweden)
Rui Ding
Full Text Available Recently, the number of studies involving complex network applications in transportation has increased steadily as scholars from various fields analyze traffic networks. Nonetheless, research on rail network growth is relatively rare. This research examines the evolution of the Public Urban Rail Transit Networks of Kuala Lumpur (PURTNoKL based on complex network theory and covers both the topological structure of the rail system and future trends in network growth. In addition, network performance when facing different attack strategies is also assessed. Three topological network characteristics are considered: connections, clustering and centrality. In PURTNoKL, we found that the total number of nodes and edges exhibit a linear relationship and that the average degree stays within the interval [2.0488, 2.6774] with heavy-tailed distributions. The evolutionary process shows that the cumulative probability distribution (CPD of degree and the average shortest path length show good fit with exponential distribution and normal distribution, respectively. Moreover, PURTNoKL exhibits clear cluster characteristics; most of the nodes have a 2-core value, and the CPDs of the centrality's closeness and betweenness follow a normal distribution function and an exponential distribution, respectively. Finally, we discuss four different types of network growth styles and the line extension process, which reveal that the rail network's growth is likely based on the nodes with the biggest lengths of the shortest path and that network protection should emphasize those nodes with the largest degrees and the highest betweenness values. This research may enhance the networkability of the rail system and better shape the future growth of public rail networks.
Complex Network Theory Applied to the Growth of Kuala Lumpur's Public Urban Rail Transit Network.
Ding, Rui; Ujang, Norsidah; Hamid, Hussain Bin; Wu, Jianjun
2015-01-01
Recently, the number of studies involving complex network applications in transportation has increased steadily as scholars from various fields analyze traffic networks. Nonetheless, research on rail network growth is relatively rare. This research examines the evolution of the Public Urban Rail Transit Networks of Kuala Lumpur (PURTNoKL) based on complex network theory and covers both the topological structure of the rail system and future trends in network growth. In addition, network performance when facing different attack strategies is also assessed. Three topological network characteristics are considered: connections, clustering and centrality. In PURTNoKL, we found that the total number of nodes and edges exhibit a linear relationship and that the average degree stays within the interval [2.0488, 2.6774] with heavy-tailed distributions. The evolutionary process shows that the cumulative probability distribution (CPD) of degree and the average shortest path length show good fit with exponential distribution and normal distribution, respectively. Moreover, PURTNoKL exhibits clear cluster characteristics; most of the nodes have a 2-core value, and the CPDs of the centrality's closeness and betweenness follow a normal distribution function and an exponential distribution, respectively. Finally, we discuss four different types of network growth styles and the line extension process, which reveal that the rail network's growth is likely based on the nodes with the biggest lengths of the shortest path and that network protection should emphasize those nodes with the largest degrees and the highest betweenness values. This research may enhance the networkability of the rail system and better shape the future growth of public rail networks.
Statistical theory and transition in multiple-scale-lengths turbulence in plasmas
Energy Technology Data Exchange (ETDEWEB)
Itoh, Sanae-I. [Research Institute for Applied Mechanics, Kyushu Univ., Kasuga, Fukuoka (Japan); Itoh, Kimitaka [National Inst. for Fusion Science, Toki, Gifu (Japan)
2001-06-01
The statistical theory of strong turbulence in inhomogeneous plasmas is developed for the cases where fluctuations with different scale-lengths coexist. Nonlinear interactions in the same kind of fluctuations as well as nonlinear interplay between different classes of fluctuations are kept in the analysis. Nonlinear interactions are modelled as turbulent drag, nonlinear noise and nonlinear drive, and a set of Langevin equations is formulated. With the help of an Ansatz of a large number of degrees of freedom with positive Lyapunov number, Langevin equations are solved and the fluctuation dissipation theorem in the presence of strong plasma turbulence has been derived. A case where two driving mechanisms (one for micro mode and the other for semi-micro mode) coexist is investigated. It is found that there are several states of fluctuations: in one state, the micro mode is excited and the semi-micro mode is quenched; in the other state, the semi-micro mode is excited, and the micro mode remains at finite but suppressed level. New type of turbulence transition is obtained, and a cusp type catastrophe is revealed. A phase diagram is drawn for turbulence which is composed of multiple classes of fluctuations. Influence of the inhomogeneous global radial electric field is discussed. A new insight is given for the physics of internal transport barrier. Finally, the nonlocal heat transport due to the long-wave-length fluctuations, which are noise-pumped by shorter-wave-length ones, is analyzed and the impact on transient transport problems is discussed. (author)
Directory of Open Access Journals (Sweden)
Paulo de Tarso Almeida Paiva
2005-12-01
Full Text Available As relações entre crescimento populacional e desenvolvimento desafiam estudiosos por muito tempo e referem-se tanto aos impactos do crescimento e estrutura da população sobre o crescimento e a distribuição da renda (crescimento econômico, quanto sobre os impactos do crescimento econômico sobre o crescimento e a estrutura da população. Há cerca de três décadas discutiam-se as causas e conseqüências do crescimento populacional. Hoje, discutem-se as causas e conseqüências da transição demográfica. Muita coisa mudou no mundo e, do ponto de vista demográfico, a maior mudança foi a universalização do processo de transição demográfica. Expressões como "bomba demográfica" foram substituídas por "bônus demográfico" ou "janela de oportunidades". Este artigo pretende examinar como essas relações entre população e economia foram interpretadas e discutidas e como influenciaram o pensamento, a pesquisa acadêmica e, eventualmente, algumas propostas de políticas públicas no Brasil. O artigo procura sumariar os avanços que estão em curso na pesquisa sobre população e economia e suas implicações para as políticas públicas e o desenvolvimento.Relationships between development and population growth have challenged scholars and researchers for many years, and refer to the impacts of population growth and distribution on economic growth, and to the impacts of economic growth on population. Three decades ago the major issue was the causes and consequences of population growth. The central issue today is about the causes and consequences of demographic transition on the economy. Many changes have taken place over the last thirty years. From the demographic point of view, the most important change has been the generalization of the so-called demographic transition. "Demographic bonus" and "window of opportunities" have become substitutes for "the demographic bomb." This article describes how the relations between population
International Nuclear Information System (INIS)
Kimura, Y.; Tokuyama, M.
2016-01-01
The full numerical solutions of the time-convolutionless modecoupling theory (TMCT) equation recently proposed by Tokuyama are compared with those of the ideal mode-coupling theory (MCT) equation based on the Percus- Yevick static structure factor for hard spheres qualitatively and quantitatively. The ergodic to non-ergodic transition at the critical volume fraction φ_c predicted by MCT is also shown to occur even for TMCT. Thus, φ_c of TMCT is shown to be much higher than that of MCT. The dynamics of coherent-intermediate scattering functions and their two-step relaxation process in a β stage are also discussed.
Transitions in Theory and Practice: Managing Metals in the Circular Economy
Directory of Open Access Journals (Sweden)
Melissa Jackson
2014-07-01
Full Text Available Transitioning from current resource management practice dominated by linear economic models of consumption and production, to circular models of resource use, will require insights into the stages and processes associated with socio-technical transitions. This paper is concerned with transitions in practice. It explores two frameworks within the transitions literature—the multi-level perspective and transition management theory—for practical guidance to inform a deliberate transition in practice. The critical futures literature is proposed as a source of tools and methods to be used in conjunction with the transition frameworks to influence and enable transitions in practice. This enhanced practical guidance for initiating action is applied to a specific context—transitioning the Australian metals sector towards a circular economy model. This particular transition case study is relevant because the vision of a circular economy model of resource management is gaining traction internationally, Australia is significant globally as a supplier of finite mineral resources and it will also be used in a collaborative research project on Wealth from Waste to investigate possibilities for the circular economy and metals recycling.
DEFF Research Database (Denmark)
Hansen, Ole Erik; Stærdahl, Jens; Søndergård, Bent
-technological systems, calling attention to how such governance structures emerge, stabilize and become dominant, which functions governance structures have to serve to become efficient, and how they can be made subject to deliberate and purposeful shaping and transition. Taking this approach, research in planning...
Does the recent evolution of Canadian mortality agree with the epidemiologic transition theory?
Directory of Open Access Journals (Sweden)
Robert ChoiniÃƒÂ¨re
2008-06-01
Full Text Available After studying the epidemiologic transition's situation in Canada, it is determined that the delimitation of temporal stages within the epidemiologic transition as put forward by Omran (1971, 1998, Olshansky and Ault (1986, Rogers and Hackenberg (1987 and Olshansky et al. (1998 does not suit the Canadian evolution. Many of the researchers' postulates on the epidemiologic transition were not confirmed, which leads us to assert that, since 1958, the epidemiologic transition is best described as an evolution process rather than specific stages confined within time limits.
International Nuclear Information System (INIS)
Hattori, Kazumasa
2010-01-01
We investigate a two-orbital Anderson lattice model with Ising orbital intersite exchange interactions on the basis of a dynamical mean field theory combined with the static mean field approximation of intersite orbital interactions. Focusing on Ce-based heavy-fermion compounds, we examine the orbital crossover between two orbital states, when the total f-electron number per site n f is ∼1. We show that a 'meta-orbital' transition, at which the occupancy of two orbitals changes steeply, occurs when the hybridization between the ground-state f-electron orbital and conduction electrons is smaller than that between the excited f-electron orbital and conduction electrons at low pressures. Near the meta-orbital critical end point, orbital fluctuations are enhanced and couple with charge fluctuations. A critical theory of meta-orbital fluctuations is also developed by applying the self-consistent renormalization theory of itinerant electron magnetism to orbital fluctuations. The critical end point, first-order transition, and crossover are described within Gaussian approximations of orbital fluctuations. We discuss the relevance of our results to CeAl 2 , CeCu 2 Si 2 , CeCu 2 Ge 2 , and related compounds, which all have low-lying crystalline-electric-field excited states. (author)
Demographic Modelling in Weed Biocontrol
Demographic matrix modeling of plant populations can be a powerful tool to identify key life stage transitions that contribute the most to population growth of an invasive plant and hence should be targeted for disruption. Therefore, this approach has the potential to guide the pre-release selection...
Social Cognitive Career Theory as Applied to the School-to-Work Transition
Kelly, Mary E.
2009-01-01
The school-to-work (STW) transition occurs when young adults leave education and enter the full-time workforce. Most high school students in the United States will not graduate from a 4-year college and instead transition into the world of work, many filling positions in sales and service. Supporters of the STW movement advocate for educational…
The General Necessary Condition for the Validity of Dirac's Transition Perturbation Theory
Quang, Nguyen Vinh
1996-01-01
For the first time, from the natural requirements for the successive approximation the general necessary condition of validity of the Dirac's method is explicitly established. It is proved that the conception of 'the transition probability per unit time' is not valid. The 'super-platinium rules' for calculating the transition probability are derived for the arbitrarily strong time-independent perturbation case.
Moriarty, John A.
1988-08-01
The first-principles, density-functional version of the generalized pseudopotential theory (GPT) developed in papers I and II of this series [Phys. Rev. B 16, 2537 (1977); 26, 1754 (1982)] for empty- and filled-d-band metals is here extended to pure transition metals with partially filled d bands. The present focus is on a rigorous, real-space expansion of the bulk total energy in terms of widely transferable, structure-independent interatomic potentials, including both central-force pair interactions and angular-force triplet and quadruplet interactions. To accomplish this expansion, a specialized set of starting equations is derived from the basic local-density formalism for a pure metal, including refined expansions for the exchange-correlation terms and a simplified yet accurate representation of the cohesive energy. The parent pseudo-Green's-function formalism of the GPT is then used to develop these equations in a plane-wave, localized-d-state basis. In this basis, the cohesive energy divides quite naturally into a large volume component and a smaller structural component. The volume component,which includes all one-ion intra-atomic energy contributions, already gives a good description of the cohesion in lowest order. The structural component is expanded in terms of weak interatomic matrix elements and gives rise to a multi-ion series which establishes the interatomic potentials. Special attention is focused on the dominant d-electron contributions to this series and complete formal results for the two-ion, three-ion, and four-ion d-state potentials (vd2, vd3, and vd4) are derived. In addition, a simplified model is used to demonstrate that while vd3 can be of comparable importance to vd2, vd4 is inherently small and the series is rapidly convergent beyond three-ion interactions. Analytic model forms are also derived for vd2 and vd3 in the case of canonical d bands. In this limit, vd2 is purely attractive and varies with interatomic distance as r-10, while
Phillips, Jordan J; Peralta, Juan E
2013-05-07
We present a method for calculating magnetic coupling parameters from a single spin-configuration via analytic derivatives of the electronic energy with respect to the local spin direction. This method does not introduce new approximations beyond those found in the Heisenberg-Dirac Hamiltonian and a standard Kohn-Sham Density Functional Theory calculation, and in the limit of an ideal Heisenberg system it reproduces the coupling as determined from spin-projected energy-differences. Our method employs a generalized perturbative approach to constrained density functional theory, where exact expressions for the energy to second order in the constraints are obtained by analytic derivatives from coupled-perturbed theory. When the relative angle between magnetization vectors of metal atoms enters as a constraint, this allows us to calculate all the magnetic exchange couplings of a system from derivatives with respect to local spin directions from the high-spin configuration. Because of the favorable computational scaling of our method with respect to the number of spin-centers, as compared to the broken-symmetry energy-differences approach, this opens the possibility for the blackbox exploration of magnetic properties in large polynuclear transition-metal complexes. In this work we outline the motivation, theory, and implementation of this method, and present results for several model systems and transition-metal complexes with a variety of density functional approximations and Hartree-Fock.
International Nuclear Information System (INIS)
Engelhardt, M.
2006-01-01
A random vortex world-surface model for the infrared sector of SU(4) Yang-Mills theory is constructed, focusing on the confinement properties and the behavior at the deconfinement phase transition. Although the corresponding data from lattice Yang-Mills theory can be reproduced, the model requires a more complex action and considerably more tuning than the SU(2) and SU(3) cases studied previously. Its predictive capabilities are accordingly reduced. This behavior has a definite physical origin, which is elucidated in detail in the present work. As the number of colors is raised in Yang-Mills theory, the corresponding infrared effective vortex description cannot indefinitely continue to rely on dynamics determined purely by vortex world-surface characteristics; additional color structures present on the vortices begin to play a role. As evidenced by the modeling effort reported here, definite signatures of this behavior appear in the case of four colors
International Nuclear Information System (INIS)
Wang Chenyang; Harrington, Jim; Preskill, John
2003-01-01
We study the ±J random-plaquette Z 2 gauge model (RPGM) in three spatial dimensions, a three-dimensional analog of the two-dimensional ±J random-bond Ising model (RBIM). The model is a pure Z 2 gauge theory in which randomly chosen plaquettes (occurring with concentration p) have couplings with the 'wrong sign' so that magnetic flux is energetically favored on these plaquettes. Excitations of the model are one-dimensional 'flux tubes' that terminate at 'magnetic monopoles' located inside lattice cubes that contain an odd number of wrong-sign plaquettes. Electric confinement can be driven by thermal fluctuations of the flux tubes, by the quenched background of magnetic monopoles, or by a combination of the two. Like the RBIM, the RPGM has enhanced symmetry along a 'Nishimori line' in the p-T plane (where T is the temperature). The critical concentration p c of wrong-sign plaquettes at the confinement-Higgs phase transition along the Nishimori line can be identified with the accuracy threshold for robust storage of quantum information using topological error-correcting codes: if qubit phase errors, qubit bit-flip errors, and errors in the measurement of local check operators all occur at rates below p c , then encoded quantum information can be protected perfectly from damage in the limit of a large code block. Through Monte-Carlo simulations, we measure p c0 , the critical concentration along the T=0 axis (a lower bound on p c ), finding p c0 =.0293±.0002. We also measure the critical concentration of antiferromagnetic bonds in the two-dimensional RBIM on the T=0 axis, finding p c0 =.1031±.0001. Our value of p c0 is incompatible with the value of p c =.1093±.0002 found in earlier numerical studies of the RBIM, in disagreement with the conjecture that the phase boundary of the RBIM is vertical (parallel to the T axis) below the Nishimori line. The model can be generalized to a rank-r antisymmetric tensor field in d dimensions, in the presence of quenched
Wigner's dynamical transition state theory in phase space: classical and quantum
International Nuclear Information System (INIS)
Waalkens, Holger; Schubert, Roman; Wiggins, Stephen
2008-01-01
We develop Wigner's approach to a dynamical transition state theory in phase space in both the classical and quantum mechanical settings. The key to our development is the construction of a normal form for describing the dynamics in the neighbourhood of a specific type of saddle point that governs the evolution from reactants to products in high dimensional systems. In the classical case this is the standard Poincaré–Birkhoff normal form. In the quantum case we develop a normal form based on the Weyl calculus and an explicit algorithm for computing this quantum normal form. The classical normal form allows us to discover and compute the phase space structures that govern classical reaction dynamics. From this knowledge we are able to provide a direct construction of an energy dependent dividing surface in phase space having the properties that trajectories do not locally 're-cross' the surface and the directional flux across the surface is minimal. Using this, we are able to give a formula for the directional flux through the dividing surface that goes beyond the harmonic approximation. We relate this construction to the flux–flux autocorrelation function which is a standard ingredient in the expression for the reaction rate in the chemistry community. We also give a classical mechanical interpretation of the activated complex as a normally hyperbolic invariant manifold (NHIM), and further describe the structure of the NHIM. The quantum normal form provides us with an efficient algorithm to compute quantum reaction rates and we relate this algorithm to the quantum version of the flux–flux autocorrelation function formalism. The significance of the classical phase space structures for the quantum mechanics of reactions is elucidated by studying the phase space distribution of scattering states. The quantum normal form also provides an efficient way of computing Gamov–Siegert resonances. We relate these resonances to the lifetimes of the quantum activated
Thomson, Dana R; Bah, Assiatou B; Rubanzana, Wilson G; Mutesa, Leon
2015-10-28
In Rwanda, women who self-reported in household surveys ever experiencing intimate partner violence (IPV) increased from 34 % in 2005 to 56 % in 2010. This coincided with a new constitution and majority-female elected parliament in 2003, and 2008 legislation protecting against gender-based violence. The increase in self-reported IPV may reflect improved social power for women, and/or disruptions to traditional gender roles that increased actual IPV. This is a cross-sectional study of IPV in 4338 couples interviewed in the 2005 and 2010 Rwanda Demographic and Health Surveys (RDHSs). Factors associated with physical or sexual IPV in the last 12 months were modeled using manual backward stepwise logistic regression. Analyses were conducted in Stata v13 adjusting for complex survey design. Risk factors for IPV in 2005 (p Rwanda's Isange One Stop Center project, with medical, legal, and psychosocial services for domestic violence victims, is currently scaling to all 44 district hospitals, and police station gender desks reduce barriers to legal reporting of IPV. Additional support to Abunzi mediators to hear IPV cases in communities, and involvement of men in grassroots efforts to redefine masculinity in Rwanda are suggested. Additional research is needed to understand why self-reported IPV has increased in Rwanda, and to evaluate effectiveness of IPV interventions.
International Nuclear Information System (INIS)
Lee, S.H.; Lee, J.T.; Sug, J.Y.; Lee, J.H.; Sa-Gong, G.
2011-01-01
We investigated theoretically the magnetic field dependence of the quantum optical transition of quasi 2-Dimensional Landau splitting system, in CdS and ZnO. Through the analysis of the current work, we found the increasing properties of the optical Quantum Transition Line Shapes (QTLSs) which show the absorption power and the Quantum Transition Line Widths(QTLWs) with the magnetic-field in CdS and ZnO. We also found that QTLW, γ(B) total of CdS total of ZnO in the magnetic field region B < 25 Tesla.
Application of the algebraic RNG model for transition simulation. [renormalization group theory
Lund, Thomas S.
1990-01-01
The algebraic form of the RNG model of Yakhot and Orszag (1986) is investigated as a transition model for the Reynolds averaged boundary layer equations. It is found that the cubic equation for the eddy viscosity contains both a jump discontinuity and one spurious root. A yet unpublished transformation to a quartic equation is shown to remove the numerical difficulties associated with the discontinuity, but only at the expense of merging both the physical and spurious root of the cubic. Jumps between the branches of the resulting multiple-valued solution are found to lead to oscillations in flat plate transition calculations. Aside from the oscillations, the transition behavior is qualitatively correct.
Application of a transitional boundary-layer theory in the low hypersonic Mach number regime
Shamroth, S. J.; Mcdonald, H.
1975-01-01
An investigation is made to assess the capability of a finite-difference boundary-layer procedure to predict the mean profile development across a transition from laminar to turbulent flow in the low hypersonic Mach-number regime. The boundary-layer procedure uses an integral form of the turbulence kinetic-energy equation to govern the development of the Reynolds apparent shear stress. The present investigation shows the ability of this procedure to predict Stanton number, velocity profiles, and density profiles through the transition region and, in addition, to predict the effect of wall cooling and Mach number on transition Reynolds number. The contribution of the pressure-dilatation term to the energy balance is examined and it is suggested that transition can be initiated by the direct absorption of acoustic energy even if only a small amount (1 per cent) of the incident acoustic energy is absorbed.
Transitivity vs. intransitivity in decision making process - an example in quantum game theory
Energy Technology Data Exchange (ETDEWEB)
Makowski, Marcin [Institute of Mathematics, University of Bialystok, Akademicka 2, PL-15424, Bialystok (Poland)], E-mail: makowski.m@gmail.com
2009-06-01
We compare two different ways of quantum modification in a simple sequential game called Cat's Dilemma in the context of the debate on intransitive and transitive preferences. This kind of analysis can have essential meaning for research on artificial intelligence (some possibilities are discussed). Nature has both transitive and intransitive properties and perhaps quantum models will be more able to capture this dualism than the classical models. We also present an electoral interpretation of the game.
Transitivity vs. intransitivity in decision making process - an example in quantum game theory
International Nuclear Information System (INIS)
Makowski, Marcin
2009-01-01
We compare two different ways of quantum modification in a simple sequential game called Cat's Dilemma in the context of the debate on intransitive and transitive preferences. This kind of analysis can have essential meaning for research on artificial intelligence (some possibilities are discussed). Nature has both transitive and intransitive properties and perhaps quantum models will be more able to capture this dualism than the classical models. We also present an electoral interpretation of the game.
Mota, Elder A V; Neto, Abel F G; Marques, Francisco C; Mota, Gunar V S; Martins, Marcelo G; Costa, Fabio L P; Borges, Rosivaldo S; Neto, Antonio M J C
2018-07-01
The electronic structures and optical properties of triphenylamine-functionalized graphene (G-TPA) doped with transition metals, using water as a solvent, were theoretically investigated to verify the efficiency of photocatalytic hydrogen production with the use of transition metals. This study was performed by Density Functional Theory and Time-dependent Density Functional Theory through Gaussian 09W software, adopting the B3LYP functional for all structures. The 6-31g(d) basis set was used for H, C and N atoms, and the LANL2DZ basis set for transition metals using the Effective Core Potentials method. Two approaches were adopted: (1) using single metallic dopants (Ni, Pd, Fe, Os and Pt) and (2) using combinations of Ni with the other dopants (NiPd, NiPt, NiFe and NiOs). The DOS spectra reveal an increase of accessible states in the valence shell, in addition to a gap decrease for all dopants. This doping also increases the absorption in the visible region of solar radiation where sunlight is most intense (400 nm to 700 nm), with additional absorption peaks. The results lead us to propose the G-TPA structures doped with Ni, Pd, Pt, NiPt or NiPd to be novel catalysts for the conversion of solar energy for photocatalytic hydrogen production, since they improve the absorption of solar energy in the range of interest for solar radiation; and act as reaction centers, reducing the required overpotential for hydrogen production from water.
Singh, Ram Chandra; Ram, Jokhan
2011-11-01
The effects of quadrupole moments on the isotropic-nematic (IN) phase transitions are studied using the density-functional theory (DFT) for a Gay-Berne (GB) fluid for a range of length-to-breadth parameters ? in the reduced temperature range ? . The pair-correlation functions of the isotropic phase, which enter into the DFT as input parameters are found by solving the Percus-Yevick integral equation theory. The method used involves an expansion of angle-dependent functions appearing in the integral equations in terms of spherical harmonics and the harmonic coefficients are obtained by an iterative algorithm. All the terms of harmonic coefficients which involve l indices up to less than or equal to 6 are considered. The numerical accuracy of the results depends on the number of spherical harmonic coefficients considered for each orientation-dependent function. As the length-to-breadth ratio of quadrupolar GB molecules is increased, the IN transition is seen to move to lower density (and pressure) at a given temperature. It has been observed that the DFT is good to study the IN transitions in such fluids. The theoretical results have also been compared with the computer simulation results wherever they are available.
Peter J. Ramberg
2000-01-01
book review of Crawford, Elisabeth: "Arrhenius: From Ionic Theory to the Greenhouse Effect" (Canton 1996); and Diana Barkan: "Walther Nernst and the Transition to Modern Physical Science" (Cambridge 1999)
The Simplest Unified Growth Theory
DEFF Research Database (Denmark)
Strulik, Holger; Weisdorf, Jacob Louis
This paper provides a unified growth theory, i.e. a model that explains the very long-run economic and demographic development path of industrialized economies, stretching from the pre-industrial era to present-day and beyond. Making strict use of Malthus' (1798) so-called preventive check...... hypothesis - that fertility rates vary inversely with the price of food - the current study offers a new and straightforward explanation for the demographic transition and the break with the Malthusian era. The current framework lends support to existing unified growth theories and is well in tune...
Cao, Xiangyu; Le Doussal, Pierre; Rosso, Alberto; Santachiara, Raoul
2018-04-01
We study transitions in log-correlated random energy models (logREMs) that are related to the violation of a Seiberg bound in Liouville field theory (LFT): the binding transition and the termination point transition (a.k.a., pre-freezing). By means of LFT-logREM mapping, replica symmetry breaking and traveling-wave equation techniques, we unify both transitions in a two-parameter diagram, which describes the free-energy large deviations of logREMs with a deterministic background log potential, or equivalently, the joint moments of the free energy and Gibbs measure in logREMs without background potential. Under the LFT-logREM mapping, the transitions correspond to the competition of discrete and continuous terms in a four-point correlation function. Our results provide a statistical interpretation of a peculiar nonlocality of the operator product expansion in LFT. The results are rederived by a traveling-wave equation calculation, which shows that the features of LFT responsible for the transitions are reproduced in a simple model of diffusion with absorption. We examine also the problem by a replica symmetry breaking analysis. It complements the previous methods and reveals a rich large deviation structure of the free energy of logREMs with a deterministic background log potential. Many results are verified in the integrable circular logREM, by a replica-Coulomb gas integral approach. The related problem of common length (overlap) distribution is also considered. We provide a traveling-wave equation derivation of the LFT predictions announced in a precedent work.
Adolescent Identity Exploration: A Test of Erikson's Theory of Transitional Crisis.
Kidwell, Jeannie S.; And Others
1995-01-01
Investigates Erikson's theory that adolescent identity exploration is associated with a variety of symptoms. Results support Erikson's theory, indicating that adolescents who were actively engaged in identity exploration were more likely to produce a personality pattern characterized by self-doubt, confusion, disturbed thinking, impulsivity,…
Directory of Open Access Journals (Sweden)
Ankit eAnand
2016-05-01
Full Text Available The millennium development goals are now replaced by seventeen sustainable development goals. The emphasis of old goals was on improving water, sanitation, and child mortality conditions in developing countries. The study explored the major question about the association between different household environment conditions with child survival and health in Sub-Saharan African and South Asian countries in the current scenario. This paper estimated the risk of death, morbidity and under-nutrition among children living in households with the improved sources of water, sanitation and non-solid cooking fuel. Two sources of information explored in this study. First, data from World Health Statistics (WHS -2014 for all of the Sub-Saharan African and South Asian countries were used. Second, available standard Demographic and Health Survey performed in the countries of Sub-Saharan Africa and South Asia after 2010, included in the study. It resulted in inclusion of 15 countries which were Bangladesh (2011, Congo Republic (2013-14, Cote d'Ivoire (2011-12, Ethiopia (2011, Gambia (2013, Mali (2012-13, Mozambique (2011, Namibia (2013, Nepal (2011, Niger (2012, Nigeria (2013, Pakistan (2012-13, Sierra Leone (2013, Uganda (2011 and Zambia (2013. The Scatter plot diagram was plotted, and the curve was fitted using the WHS-2014. Cox regression and logistic regression were used to estimate adjusted risks (odds ratio of child mortality and health outcomes using DHS surveys. The use of non-solid cooking fuel was very high in most of the Sub-Saharan African and South Asian Countries. There was a positive correlation between improving access to safe drinking water and sanitation. The exponential curve fitted well with child mortality and Household environmental indicators. The use of improved source of water and sanitation significantly related with the lower odds ratio of death, morbidity and under-nutrition among children aged 12-59 months. The risks were not
International Nuclear Information System (INIS)
Zalialiutdinov, T; Baukina, Yu; Solovyev, D; Labzowsky, L
2014-01-01
The theory of multiphoton cascade transitions with two-photon links is considered within two different approaches: quantum electrodynamical (QED) and phenomenological quantum mechanical (QM). A problem of regularization of the cascade contributions is investigated in detail. It is argued that the correct regularization should include both initial and intermediate level widths in the singular energy denominators. This result follows both from the QED and from the QM approach. Particular transitions nl → 1s + 2γ with nl = 3s, 4s, 3d, 4d and nl → 1s + 3γ with nl = 3p, 4p are considered as examples. The importance of the proper cascade regularization is also demonstrated. (paper)
Complexity and demographic explanations of cumulative culture
Querbes, A.; Vaesen, K.; Houkes, W.N.
2014-01-01
Formal models have linked prehistoric and historical instances of technological change (e.g., the Upper Paleolithic transition, cultural loss in Holocene Tasmania, scientific progress since the late nineteenth century) to demographic change. According to these models, cumulation of technological
Directory of Open Access Journals (Sweden)
M.F. Holovko
2017-12-01
Full Text Available The scaled particle theory is developed for the description of thermodynamical properties of a mixture of hard spheres and hard spherocylinders. Analytical expressions for free energy, pressure and chemical potentials are derived. From the minimization of free energy, a nonlinear integral equation for the orientational singlet distribution function is formulated. An isotropic-nematic phase transition in this mixture is investigated from the bifurcation analysis of this equation. It is shown that with an increase of concentration of hard spheres, the total packing fraction of a mixture on phase boundaries slightly increases. The obtained results are compared with computer simulations data.
DEFF Research Database (Denmark)
Verma, Ashok K.; Modak, P.; Sharma, Surinder M.
2013-01-01
First-principles calculations have been performed for americium (Am) metal using the generalized gradient approximation + orbital-dependent onsite Coulomb repulsion via Hubbard interaction (GGA+U) and hybrid density functional theory (HYB-DFT) methods to investigate various ground state properties......-I to Am-II transition. Good agreement was found between calculated and experimental equations of states for all phases, but the first three phases need larger U (α) parameters (where α represents the fraction of Hartree-Fock exchange energy replacing the DFT exchange energy) than the fourth phase in order...
On a phase transition of a Kosterlitz-thouless-type in the d=4, U(1)-lattice gauge theory
International Nuclear Information System (INIS)
Marchetti, D.H.U.; Perez, J.F.
1986-12-01
The d=4, U(1)-lattice gauge theory with the Villain action may be represented as a locally neutral gas of topological (plaquette) charges which interact via a logarithmically confining potential, is shown. Using this representation a renormalization group analysis to show the existence of a phase transition of the Kosterlitz-Thouless-type was performed. An improved hierarchical version of the model which displays (unlike the usual Migdal-Kadanoff approach) a stable line of gaussian fixed points at low temperatures, which should correspond to the usual deconfining region of these systems is presented. (Author) [pt
Starr, Francis W.; Douglas, Jack F.; Sastry, Srikanth
2013-01-01
We carefully examine common measures of dynamical heterogeneity for a model polymer melt and test how these scales compare with those hypothesized by the Adam and Gibbs (AG) and random first-order transition (RFOT) theories of relaxation in glass-forming liquids. To this end, we first analyze clusters of highly mobile particles, the string-like collective motion of these mobile particles, and clusters of relative low mobility. We show that the time scale of the high-mobility clusters and stri...
Statistical theory of L-H transition and its implication to threshold database
International Nuclear Information System (INIS)
Itoh, S.-I.; Itoh, K.; Toda, S.
2003-01-01
A statistical model for the bifurcation of the radial electric field E r is analyzed in view of describing L-H transitions of toroidal plasmas. Noise in micro fluctuations is shown to lead to random changes of E r , if a deterministic approach allows for more than one solution. The probability density function for and the ensemble average of E r are obtained. The L-to-H and the H-to-L transition probabilities are calculated, and the effective phase limit is derived. Due to the suppression of turbulence by shear in E r , the limit deviates from Maxwell's rule. (author)
Theory of collisional excitation transition between Rydberg states of atoms. Non-inertial mechanism
International Nuclear Information System (INIS)
Kaulakys, B.P.
1982-01-01
The transitions between highly states of an atom due to the collision of its core with another atom are considered. The cross sections of the change of highly excited electron angular momentum, in the case of the transitions when the main quantum number is constant, are expressed in terms of transport cross sections of the perturbing atom scattering on the ion of Rydberg atom. It is shown that the cross sections of the momentum mixing at thermal rapidities are lower than the cross sections of the atom-ion elastic scattering
Hahne, G. E.
1991-01-01
A formal theory of the scattering of time-harmonic acoustic scalar waves from impenetrable, immobile obstacles is established. The time-independent formal scattering theory of nonrelativistic quantum mechanics, in particular the theory of the complete Green's function and the transition (T) operator, provides the model. The quantum-mechanical approach is modified to allow the treatment of acoustic-wave scattering with imposed boundary conditions of impedance type on the surface (delta-Omega) of an impenetrable obstacle. With k0 as the free-space wavenumber of the signal, a simplified expression is obtained for the k0-dependent T operator for a general case of homogeneous impedance boundary conditions for the acoustic wave on delta-Omega. All the nonelementary operators entering the expression for the T operator are formally simple rational algebraic functions of a certain invertible linear radiation impedance operator which maps any sufficiently well-behaved complex-valued function on delta-Omega into another such function on delta-Omega. In the subsequent study, the short-wavelength and the long-wavelength behavior of the radiation impedance operator and its inverse (the 'radiation admittance' operator) as two-point kernels on a smooth delta-Omega are studied for pairs of points that are close together.
International Nuclear Information System (INIS)
Vaz, L.C.; Alexander, J.M.
1983-01-01
Fission angular distributions have been studied for years and have been treated as classic examples of transition-state theory. Early work involving composite nuclei of relatively low excitation energy Esup(*) ( 2 0 (K 2 0 = Psub(eff)T/(h/2π) 2 ) are presented along with comparissons of Psub(eff) to moments of inertia for saddle-point nuclei from the rotating liquid drop model. This model gives an excellent guide for the intermediate spin zone (30 < or approx. I < or approx. 65), while strong shell and/or pairing effects are evident for excitations less than < or approx. 35 MeV. Observations of strong anisotropies for very high-spin systems signal the demise of certain approximations commonly made in the theory, and suggestions are made toward this end. (orig.)
Abrahams, Elihu; Wölfle, Peter
2012-01-01
We use the recently developed critical quasiparticle theory to derive the scaling behavior associated with a quantum critical point in a correlated metal. This is applied to the magnetic-field induced quantum critical point observed in YbRh2Si2, for which we also derive the critical behavior of the specific heat, resistivity, thermopower, magnetization and susceptibility, the Grüneisen coefficient, and the thermal expansion coefficient. The theory accounts very well for the available experimental results. PMID:22331893
DEFF Research Database (Denmark)
Martinez, Jose Ignacio; García Lastra, Juan Maria; Lopez, M. J.
2010-01-01
The optical spectra of sandwich clusters formed by transition metal atoms (titanium, vanadium, and chromium) intercalated between parallel benzene molecules have been studied by time-dependent density functional theory (TDDFT) and many-body perturbation theory. Sandwiches with different number...
The Case for a Dual-Process Theory of Transitive Reasoning
Wright, Barlow C.
2012-01-01
Ever since its popularisation by Piaget around 60 years ago, transitive reasoning (deductively-inferring A greater than C from premises A greater than B and B greater than C) has been of psychological interest both as a mental phenomenon and as a tool in areas of psychological discourse. However, the focus of interest in it has shifted…
Latent Transition Analysis with a Mixture Item Response Theory Measurement Model
Cho, Sun-Joo; Cohen, Allan S.; Kim, Seock-Ho; Bottge, Brian
2010-01-01
A latent transition analysis (LTA) model was described with a mixture Rasch model (MRM) as the measurement model. Unlike the LTA, which was developed with a latent class measurement model, the LTA-MRM permits within-class variability on the latent variable, making it more useful for measuring treatment effects within latent classes. A simulation…
Theory of pure rotational transitions in doubly degenerate torsional states of ethane
Rosenberg, A.; Susskind, J.
1979-01-01
It is shown that pure rotational transitions in doubly degenerate torsional states of C2H6 (with selection rules Delta K = 0, plus or minus 1) are made allowed by Coriolis interaction between torsion and dipole-allowed vibrations. Expressions are presented for integrated intensities from which strengths of lines in the millimeter region can be calculated.
The evolution of bank credit quality in transition : theory and evidence from Romania
Perotti, E.C.; Carare, O.
1996-01-01
The paper develops a simple theoretical framework of financial discipline during the stabilization of a transition economy, from which it derives an empirical measure to assess whether the banking sector has started to act as a source of financial discipline, or just as a temporary buffer for
Hassink, J.; Grin, J.; Hulsink, W.
2010-01-01
The authors analyzed two types of regional cooperation. Regional foundations of care farms and care institutions collaborating with a group of farmers. The initiatives were analyzed with a conceptual framework based on transition sciences and institutional entrepreneurship. The presence of a
A thermodynamically-consistent theory of the ferro/paramagnetic transition
Czech Academy of Sciences Publication Activity Database
Podio-Guidugli, P.; Roubíček, Tomáš; Tomassetti, G.
2010-01-01
Roč. 198, č. 3 (2010), s. 1057-1094 ISSN 0003-9527 Institutional research plan: CEZ:AV0Z20760514 Keywords : phase transitions * thermodynamics of continua * landau-lifshitz/gilbert equation Subject RIV: BJ - Thermodynamics Impact factor: 2.277, year: 2010 http://www.springerlink.com/content/u705l057177m6526/
Perturbation theory of a superconducting 0−π impurity quantum phase transition
Czech Academy of Sciences Publication Activity Database
Žonda, M.; Pokorný, Vladislav; Janiš, Václav; Novotný, T.
2015-01-01
Roč. 5, Mar (2015), s. 8821 ISSN 2045-2322 R&D Projects: GA ČR GCP204/11/J042 Institutional support: RVO:68378271 Keywords : quantum dot * superconductivity * Josephson current * quantum phase transition * perturbation expansion Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 5.228, year: 2015
Biedenharn transformation in the theory of H ion. Probabilities of radiative transitions
International Nuclear Information System (INIS)
Zapryagaev, S.A.
1987-01-01
The solution of the Dirac equation in the Coulomb field is investigated by means of an anti-unitary transformation, reducing the set of relativistic equations to a non-relativistic equation. The obtained solutions are used to calculate probabilities of radiational transitions between fine-structure and hyperfine-structure levels of the H ion with an arbitrary nuclear charge
Directory of Open Access Journals (Sweden)
R Nourafkan
2009-08-01
Full Text Available It is a common knowledge that the formation of electron pairs is a necessary ingredient of any theoretical work describing superconductivity. Thus, finding the mechanism of the formation of the electron pairs is of utmost importance. There are some experiments on high transition temperature superconductors which support the electron-phonon (e-ph interactions as the pairing mechanism (ARPES, and there are others which support the spin fluctuations as their pairing mechanism (tunneling spectroscopy. In this paper, we introduce the Holstein-Kondo lattice model (H-KLM which incorporates the e-ph as well as the Kondo exchange interaction. We have used the dynamical mean field theory (DMFT to describe heavy fermion semiconductors and have employed the exact-diagonalization technique to obtain our results. The phase diagram of these systems in the parameter space of the e-ph coupling, g, and the Kondo exchange coupling, J, show that the system can be found in the Kondo insulating phase, metallic phase or the bi-polaronic phase. It is shown that these systems develop both spin gap and a charge gap, which are different and possess energies in the range of 1-100 meV. In view of the fact that both spin excitation energies and phonon energies lie in this range, we expect our work on H-KLM opens a way to formalize the theory of the high transition temperature superconductors .
Transition operators in electromagnetic-wave diffraction theory. II - Applications to optics
Hahne, G. E.
1993-01-01
The theory developed by Hahne (1992) for the diffraction of time-harmonic electromagnetic waves from fixed obstacles is briefly summarized and extended. Applications of the theory are considered which comprise, first, a spherical harmonic expansion of the so-called radiation impedance operator in the theory, for a spherical surface, and second, a reconsideration of familiar short-wavelength approximation from the new standpoint, including a derivation of the so-called physical optics method on the basis of quasi-planar approximation to the radiation impedance operator, augmented by the method of stationary phase. The latter includes a rederivation of the geometrical optics approximation for the complete Green's function for the electromagnetic field in the presence of a smooth- and a convex-surfaced perfectly electrically conductive obstacle.
Kerner, Boris S; Klenov, Sergey L; Schreckenberg, Michael
2014-05-01
Physical features of induced phase transitions in a metastable free flow at an on-ramp bottleneck in three-phase and two-phase cellular automaton (CA) traffic-flow models have been revealed. It turns out that at given flow rates at the bottleneck, to induce a moving jam (F → J transition) in the metastable free flow through the application of a time-limited on-ramp inflow impulse, in both two-phase and three-phase CA models the same critical amplitude of the impulse is required. If a smaller impulse than this critical one is applied, neither F → J transition nor other phase transitions can occur in the two-phase CA model. We have found that in contrast with the two-phase CA model, in the three-phase CA model, if the same smaller impulse is applied, then a phase transition from free flow to synchronized flow (F → S transition) can be induced at the bottleneck. This explains why rather than the F → J transition, in the three-phase theory traffic breakdown at a highway bottleneck is governed by an F → S transition, as observed in real measured traffic data. None of two-phase traffic-flow theories incorporates an F → S transition in a metastable free flow at the bottleneck that is the main feature of the three-phase theory. On the one hand, this shows the incommensurability of three-phase and two-phase traffic-flow theories. On the other hand, this clarifies why none of the two-phase traffic-flow theories can explain the set of fundamental empirical features of traffic breakdown at highway bottlenecks.
Using experimental game theory to transit human values to ethical AI
Wang, Yijia; Wan, Yan; Wang, Zhijian
2017-01-01
Knowing the reflection of game theory and ethics, we develop a mathematical representation to bridge the gap between the concepts in moral philosophy (e.g., Kantian and Utilitarian) and AI ethics industry technology standard (e.g., IEEE P7000 standard series for Ethical AI). As an application, we demonstrate how human value can be obtained from the experimental game theory (e.g., trust game experiment) so as to build an ethical AI. Moreover, an approach to test the ethics (rightness or wrongn...
Sung, Connie; Connor, Annemarie
2017-08-01
This study examined the utility of social-cognitive career theory (SCCT; Lent, Brown, & Hackett, 1994) as a framework to investigate career self-efficacy, outcome expectations, goals, and contextual supports and barriers as predictors of choice actions among transition-age individuals with epilepsy. Moreover, these SCCT constructs are offered as an operational definition of work participation in this population. Using a quantitative descriptive research design and hierarchical regression analysis (HRA), 90 transition-age individuals with epilepsy, age 18-25, were recruited from affiliates of the Epilepsy Foundation and invited to complete an online survey comprised of a series of self-report social-cognitive measures. The HRA findings indicated that self-efficacy, outcome expectations, and environmental supports were significant predictors of work participation in youth and young adults with epilepsy. The final model accounted for 58% of the variance in work participation, which is considered a large effect size. The research findings provide support for the use of the SCCT framework to identify predictors of work participation and to provide guidance for designing customized vocational rehabilitation services and career development interventions for individuals with epilepsy in the transition from adolescence to adulthood. (PsycINFO Database Record (c) 2017 APA, all rights reserved).
Kumar, S Santhosh; Shankaranarayanan, S
2017-11-17
In a bipartite set-up, the vacuum state of a free Bosonic scalar field is entangled in real space and satisfies the area-law- entanglement entropy scales linearly with area of the boundary between the two partitions. In this work, we show that the area law is violated in two spatial dimensional model Hamiltonian having dynamical critical exponent z = 3. The model physically corresponds to next-to-next-to-next nearest neighbour coupling terms on a lattice. The result reported here is the first of its kind of violation of area law in Bosonic systems in higher dimensions and signals the evidence of a quantum phase transition. We provide evidence for quantum phase transition both numerically and analytically using quantum Information tools like entanglement spectra, quantum fidelity, and gap in the energy spectra. We identify the cause for this transition due to the accumulation of large number of angular zero modes around the critical point which catalyses the change in the ground state wave function due to the next-to-next-to-next nearest neighbor coupling. Lastly, using Hubbard-Stratanovich transformation, we show that the effective Bosonic Hamiltonian can be obtained from an interacting fermionic theory and provide possible implications for condensed matter systems.
International Nuclear Information System (INIS)
Mohan, Harsh; Kumar Jain, Arvind; Kaur, Gurpreet; Singh, Parjit S.; Sharma, Sunita
2012-01-01
The inner-shell vacancy decay process is consisting of radiative and non-radiative transitions. These investigations have been developing over the last four decades, resulting in close and stringent comparisons of the measured values with the predictions of theoretical models. In view of the current state of affairs, we report in this paper the role of Fluorescence yields, Coster–Kronig transitions and prevailing ionization theories on L X-ray production from Au using low energy protons. Their contribution to these phenomena and current growth will be highlighted. Prospects for supplementary effort will also be discussed. - Highlights: ► New data for L X-ray production from Au using low energy protons are reported. ► Effects of Fluorescence yields and Coster–Kronig transitions on it are analyzed. ► Stringent comparison of measured values with theoretical models has been presented.► Their contribution to these phenomena and current growth has been highlighted. ► Prospects for supplementary effort are discussed.
Large scale structure from biased non-equilibrium phase transitions percolation theory picture
Lalak, Z; Ovrut, B A; Ross, Graham G
1995-01-01
We give an analytical description of the spatial distribution of domain walls produced during a biased nonequilibrium phase transition in the vacuum state of a light scalar field. We discuss in detail the spectrum of the associated cosmological energy density perturbations. It is shown that the contribution coming from domain walls can enhance the standard cold dark matter spectrum in such a way as to account for the whole range of IRAS data and for the COBE measurement of the microwave background anisotropy. We also demonstrate that in case of a biased phase transition which allows a percolative description, the number of large size domain walls is strongly suppressed. This offers a way of avoiding excessive microwave background distorsions due to the gravitational field of domain walls present after decoupling.
Linear stability theory as an early warning sign for transitions in high dimensional complex systems
International Nuclear Information System (INIS)
Piovani, Duccio; Grujić, Jelena; Jensen, Henrik Jeldtoft
2016-01-01
We analyse in detail a new approach to the monitoring and forecasting of the onset of transitions in high dimensional complex systems by application to the Tangled Nature model of evolutionary ecology and high dimensional replicator systems with a stochastic element. A high dimensional stability matrix is derived in the mean field approximation to the stochastic dynamics. This allows us to determine the stability spectrum about the observed quasi-stable configurations. From overlap of the instantaneous configuration vector of the full stochastic system with the eigenvectors of the unstable directions of the deterministic mean field approximation, we are able to construct a good early-warning indicator of the transitions occurring intermittently. (paper)
Theory of coherent transition radiation generated at a plasma-vacuum interface
Energy Technology Data Exchange (ETDEWEB)
Schroeder, Carl B.; Esarey, Eric; van Tilborg, Jeroen; Leemans, Wim P.
2003-06-26
Transition radiation generated by an electron beam, produced by a laser wakefield accelerator operating in the self-modulated regime, crossing the plasma-vacuum boundary is considered. The angular distributions and spectra are calculated for both the incoherent and coherent radiation. The effects of the longitudinal and transverse momentum distributions on the differential energy spectra are examined. Diffraction radiation from the finite transverse extent of the plasma is considered and shown to strongly modify the spectra and energy radiated for long wavelength radiation. This method of transition radiation generation has the capability of producing high peak power THz radiation, of order 100 (mu)J/pulse at the plasma-vacuum interface, which is several orders of magnitude beyond current state-of-the-art THz sources.
Political competition, economic reform and growth : theory and evidence from transition countries
Pavletic, Ivan
2010-01-01
Which political and institutional factors trigger reforms that enable the poor to benefit from the process of economic growth? How can the incentives of policy makers be influenced in order to achieve such a dynamic? These are the questions this study seeks to address by examining the transition process in post-communist countries. The author argues that political competition within an accepted and respected institutional environment has been a driving force in shaping the direction and succe...
Modeling mechanical properties of a shear thickening fluid damper based on phase transition theory
Wei, Minghai; Lin, Kun; Guo, Qian
2018-03-01
Shear thickening fluids (STFs) are highly concentrated colloidal suspensions consisting of monodisperse nano-particles suspended in a carrying fluid, and have the capacity to display both flowable and rigid behaviors, when subjected to sudden stimuli. In that process, the external energy that acts on an STF can be dissipated quickly. The aim of this study is to present a dynamic model of a damper filled with STF that can be directly used in control engineering fields. To this end, shear stress during phase transition of the STF material is chosen as an internal variable. A non-convex function with bifurcation behavior is used to describe the phase transitioning of STF by determining the relationship between the behavioral characteristics of the microscopic phase and macroscopic damping force. This model is able to predict force-velocity and force-displacement relationships as functions of the loading frequency. Efficacy of the model is demonstrated via comparison with experimental results from previous studies. In addition, the results confirm the hypothesis regarding the occurrence of STF phase transitioning when subject to shear stress.
Zhang, Wen; Liu, Peiqing; Guo, Hao; Wang, Jinjun
2017-11-01
The permutation entropy and the statistical complexity are employed to study the boundary-layer transition induced by the surface roughness. The velocity signals measured in the transition process are analyzed with these symbolic quantifiers, as well as the complexity-entropy causality plane, and the chaotic nature of the instability fluctuations is identified. The frequency of the dominant fluctuations has been found according to the time scales corresponding to the extreme values of the symbolic quantifiers. The laminar-turbulent transition process is accompanied by the evolution in the degree of organization of the complex eddy motions, which is also characterized with the growing smaller and flatter circles in the complexity-entropy causality plane. With the help of the permutation entropy and the statistical complexity, the differences between the chaotic fluctuations detected in the experiments and the classical Tollmien-Schlichting wave are shown and discussed. It is also found that the chaotic features of the instability fluctuations can be approximated with a number of regular sine waves superimposed on the fluctuations of the undisturbed laminar boundary layer. This result is related to the physical mechanism in the generation of the instability fluctuations, which is the noise-induced chaos.
Electric transition dipole moment in pre-Born-Oppenheimer molecular structure theory.
Simmen, Benjamin; Mátyus, Edit; Reiher, Markus
2014-10-21
This paper presents the calculation of the electric transition dipole moment in a pre-Born-Oppenheimer framework. Electrons and nuclei are treated equally in terms of the parametrization of the non-relativistic total wave function, which is written as a linear combination of basis functions constructed from explicitly correlated Gaussian functions and the global vector representation. The integrals of the electric transition dipole moment are derived corresponding to these basis functions in both the length and the velocity representation. The calculations are performed in laboratory-fixed Cartesian coordinates without relying on coordinates which separate the center of mass from the translationally invariant degrees of freedom. The effect of the overall motion is eliminated through translationally invariant integral expressions. The electric transition dipole moment is calculated between two rovibronic levels of the H2 molecule assignable to the lowest rovibrational states of the X (1)Σ(g)(+) and B (1)Σ(u)(+) electronic states in the clamped-nuclei framework. This is the first evaluation of this quantity in a full quantum mechanical treatment without relying on the Born-Oppenheimer approximation.
The gamma N ---> Delta transition in chiral effective-field theory.
Energy Technology Data Exchange (ETDEWEB)
Vladimir Pascalutsa; Marc Vanderhaeghen
2006-04-27
We describe the pion electroproduction processes in the {Delta}(1232)-resonance region within the framework of chiral effective-field theory. By studying the observables of pion electroproduction in a next-to-leading order calculation we are able to make predictions and draw conclusions on the properties of the N {yields} {Delta} electromagnetic form factors.
The $\\gamma N\\to \\De$ transition in chiral effective-field theory
Energy Technology Data Exchange (ETDEWEB)
Vladimir Pascalutsa; Marc Vanderhaeghen
2006-04-27
We describe the pion electroproduction processes in the {Delta}(1232)-resonance region within the framework of chiral effective-field theory. By studying the observables of pion electroproduction in a next-to-leading order calculation we are able to make predictions and draw conclusions on the properties of the N {yields} {Delta} electromagnetic form factors.
Ewing, Douglas R.; Ewing, Randall L.
2017-01-01
Drawing on identity theory, this conceptual inquiry posits a need to redefine the standard that individuals use to judge themselves as a "business student." Learners will be more likely to succeed in a corporate context if they experience daily interactions throughout a curriculum that approximate a professional environment. These social…
Peers, Chris
2015-01-01
This article addresses educational practice as a site for the development of human capital theory. The article considers metaphysical constructions that are broadly typical of educational thought, and shows how they are amenable to economic analysis. Using different Marxist and feminist methods, it discusses pedagogy and the family as kinds of…
Spontaneous transition to a stochastic state in a four-dimensional Yang-Mills quantum theory
International Nuclear Information System (INIS)
Semikhatov, A.M.
1983-01-01
The quantum expectation values in a four-dimensional Yang-Mills theory are represented in each topological sector as expectation values over the diffusion which develops in the ''fourth'' Euclidean time. The Langevin equations of this diffusion are stochastic duality equations in the A 4 = 0 gauge
Making the Connection: The Use of Student Development Theory in First-Year and Transition Programs
Torres, Vasti; LePeau, Lucy A.
2013-01-01
This article focuses on past and present research studies that examined the creation of developmental theories to help understand how students develop while in college. The implications of this manuscript include understanding how the diversity of today's student body influences practice, considering the appropriate knowledge base needed to…
International Nuclear Information System (INIS)
Suslov, Igor' M
1998-01-01
The calculation of the density of states for the Schroedinger equation with a Gaussian random potential is equivalent to the problem of a second-order transition with a 'wrong' sign for the coefficient of the quartic term in the Ginzburg-Landau Hamiltonian. The special role of the dimension d = 4 for such a Hamiltonian can be seen from different viewpoints but is fundamentally determined by the renormalizability of the theory. The construction of an ε expansion in direct analogy with the phase-transition theory gives rise to the problem of a 'spurious' pole. To solve this problem, a proper treatment of the factorial divergency of the perturbation series is necessary. Simplifications arising in high dimensions can be used for the development of a (4-ε)-dimensional theory, but this requires successive consideration of four types of theories: a nonrenormalizable theories for d > 4, nonrenormalizable and renormalizable theories in the logarithmic situation (d = 4), and a super-renormalizable theories for d < 4. An approximation is found for each type of theory giving asymptotically exact results. In the (4-ε)-dimensional theory, the terms of leading order in 1/ε are only retained for N∼1 (N is the order of the perturbation theory) while all degrees of 1/ε are essential for large N in view of the fast growth of their coefficients. The latter are calculated in the leading order in N from the Callan-Symanzik equation with the results of Lipatov method used as boundary conditions. The qualitative effect is the same in all four cases and consists in a shifting of the phase transition point in the complex plane. This results in the elimination of the 'spurious' pole and in regularity of the density of states for all energies. A discussion is given of the calculation of high orders of perturbation theory and a perspective of the ε expansion for the problem of conductivity near the Anderson transition. (reviews of topical problems)
Density-functional theory for f-electron systems. The α-γ phase transition in cerium
International Nuclear Information System (INIS)
Casadei, Marco
2013-01-01
Rare earths are technologically important and scientifically highly interesting elements. The description of the volume collapse exhibited by some rare earth metals poses a great challenge to density-functional theory (DFT) since local/semi-local functionals (LDA/GGA) only partially capture the associated phase transitions. In this work this problem is approached by treating all electrons at the same quantum mechanical level, using both hybrid functionals (e.g. PBE0 and HSE06) and exact-exchange plus correlation in the random-phase approximation (EX+cRPA). The performance of recently developed beyond RPA schemes is also assessed. The isostructural α-γ phase transition in cerium is the most studied. The exact exchange contribution in PBE0 and HSE06 is crucial to produce two distinct solutions that can be associated with the α and γ phases. The two solutions emerge in bulk as well as in cluster calculations. Most notable is their presence in the cerium dimer. However, quantitative agreement with the extrapolated phase diagram requires EX+cRPA. So far the EX+cRPA correction can only be applied to cerium clusters and not to the bulk. A cluster of 19 atoms cut from the fcc crystal structure (the same that characterizes the α and γ phases) was therefore determined as representative. (EX+cRPA) rate at PBE0 for Ce 19 provides good agreement with the extrapolated transition pressure to zero temperature. We predict that a pressure induced phase transition should exist at or close to zero. A finite temperature phase diagram can be drawn in reasonable agreement with experiment by adding entropic effects. The cerium neighbors are also studied: lanthanum, which has no f electrons, praseodymium, with three f electrons and a volume collapse, and neodymium, with four f electrons and no volume collapse. Multiple solutions are also present for these f electron elements, confirming the importance of exact-exchange for f electron systems.
Stability theory and transition prediction applied to a general aviation fuselage
Spall, R. E.; Wie, Y.-S.
1993-01-01
The linear stability of a fully three-dimensional boundary layer formed over a general aviation fuselage was investigated. The location of the onset of transition was estimated using the N-factor method. The results were compared with existing experimental data and indicate N-factors of approximately 8.5 on the side of the fuselage and 3.0 near the top. Considerable crossflow existed along the side of the body, which significantly affected the unstable modes present in the boundary layer. Fair agreement was found between the predicted frequency range of linear instability modes and available experimental data concerning the spectral content of the boundary layer.
Traditional fire-use, landscape transition, and the legacies of social theory past.
Coughlan, Michael R
2015-12-01
Fire-use and the scale and character of its effects on landscapes remain hotly debated in the paleo- and historical-fire literature. Since the second half of the nineteenth century, anthropology and geography have played important roles in providing theoretical propositions and testable hypotheses for advancing understandings of the ecological role of human-fire-use in landscape histories. This article reviews some of the most salient and persistent theoretical propositions and hypotheses concerning the role of humans in historical fire ecology. The review discusses this history in light of current research agendas, such as those offered by pyrogeography. The review suggests that a more theoretically cognizant historical fire ecology should strive to operationalize transdisciplinary theory capable of addressing the role of human variability in the evolutionary history of landscapes. To facilitate this process, researchers should focus attention on integrating more current human ecology theory into transdisciplinary research agendas.
Random Matrix Theory of the Energy-Level Statistics of Disordered Systems at the Anderson Transition
Canali, C. M.
1995-01-01
We consider a family of random matrix ensembles (RME) invariant under similarity transformations and described by the probability density $P({\\bf H})= \\exp[-{\\rm Tr}V({\\bf H})]$. Dyson's mean field theory (MFT) of the corresponding plasma model of eigenvalues is generalized to the case of weak confining potential, $V(\\epsilon)\\sim {A\\over 2}\\ln ^2(\\epsilon)$. The eigenvalue statistics derived from MFT are shown to deviate substantially from the classical Wigner-Dyson statistics when $A
Luo, Sijie; Averkiev, Boris; Yang, Ke R; Xu, Xuefei; Truhlar, Donald G
2014-01-14
The 3d-series transition metals (also called the fourth-period transition metals), Sc to Zn, are very important in industry and biology, but they provide unique challenges to computing the electronic structure of their compounds. In order to successfully describe the compounds by theory, one must be able to describe their components, in particular the constituent atoms and cations. In order to understand the ingredients required for successful computations with density functional theory, it is useful to examine the performance of various exchange-correlation functionals; we do this here for 4s(N)3d(N') transition-metal atoms and their cations. We analyze the results using three ways to compute the energy of the open-shell states: the direct variational method, the weighted-averaged broken symmetry (WABS) method, and a new broken-symmetry method called the reinterpreted broken symmetry (RBS) method. We find the RBS method to be comparable in accuracy with the WABS method. By examining the overall accuracy in treating 18 multiplicity-changing excitations and 10 ionization potentials with the RBS method, 10 functionals are found to have a mean-unsigned error of systems, the M06-L functional is the most accurate. And by combining the results with our previous studies of p-block and 4d-series elements as well as databases for alkyl bond dissociation, main-group atomization energies, and π-π noncovalent interactions, we find five functionals, namely, PW6B95, MPW1B95, M08-SO, SOGGA11-X, and MPWB1K, to be highly recommended. We also studied the performance of PW86 and C09 exchange functionals, which have drawn wide interest in recent studies due to their claimed ability to reproduce Hartree-Fock exchange at long distance. By combining them with four correlation functionals, we find the performance of the resulting functionals disappointing both for 3d transition-metal chemistry and in broader tests, and thus we do not recommend PW86 and C09 as components of generalized
Product variety and the demographic transition
DEFF Research Database (Denmark)
Guzmán, Ricardo Andrés; Weisdorf, Jacob Louis
2010-01-01
Why does the rate of population growth decline in the face of economic growth? We show that growing product variety may induce a permanent reduction in the demand for children and a continuous rise in income and consumption.......Why does the rate of population growth decline in the face of economic growth? We show that growing product variety may induce a permanent reduction in the demand for children and a continuous rise in income and consumption....
Product Variety and the Demographic Transition
DEFF Research Database (Denmark)
Guzmán, Ricardo Andrés; Weisdorf, Jacob Louis
Why does the rate of population growth decline in the face of economic growth? We show that growing product variety may induce a permanent reduction in the demand for children and a continuous rise in income and consumption.......Why does the rate of population growth decline in the face of economic growth? We show that growing product variety may induce a permanent reduction in the demand for children and a continuous rise in income and consumption....
The lobe to plasma sheet boundary layer transition: Theory and observations
International Nuclear Information System (INIS)
Schriver, D.; Ashour-Abdalla, M.; Treumann, R.; Nakamura, M.; Kistler, L.M.
1990-01-01
The lobe and the plasma sheet boundary layer in the Earth's magnetotail are regions of different plasma conditions and share a common interface. The transition from the lobe to the plasma sheet boundary layer is examined here using AMPTE/IRM data. When the satellite crossed from the lobe to the plasma sheet boundary layer, intense narrow banded wave bursts at 1 kHz were observed an d then broadband electrostatic noise (BEN) immediately followed. Simultaneous with the onset of BEN, high energy earthward streaming proton beams at > 40 keV (> 2,700 km/s) were detected. These results are used as input into a numerical simulation to study ion beam instabilities in the PSBL
Allowance for change in the solvent frequency spectrum in the theory of nonadiabatic transitions
International Nuclear Information System (INIS)
Ponomarev, O.A.; Khabibullin, R.M.
1989-01-01
An explicit expression is obtained for the correlation function of a vibrational subsystem that takes into account memory of the state of the electron subsystem. The correlation function is represented in terms of the retarded Green's functions of the vibrational subsystem for different electron states. The singular equation for the correlation function are solved by reducing them to a canonical system and to the Riemann problem of the jump of a vector function with subsequent nonlinear factorization. This made it possible to solve exactly the problem for an arbitrary initial correlation function and calculate the effect that a change in the frequency spectrum of the solvent has on the process rate constant in the case of a nonradiative transition
Nandi, Prithwish Kumar; Valsakumar, M C; Chandra, Sharat; Sahu, H K; Sundar, C S
2010-09-01
We calculate properties like equilibrium lattice parameter, bulk modulus and monovacancy formation energy for nickel (Ni), iron (Fe) and chromium (Cr) using Kohn-Sham density functional theory (DFT). We compare the relative performance of local density approximation (LDA) and generalized gradient approximation (GGA) for predicting such physical properties for these metals. We also make a relative study between two different flavors of GGA exchange correlation functional, namely PW91 and PBE. These calculations show that there is a discrepancy between DFT calculations and experimental data. In order to understand this discrepancy in the calculation of vacancy formation energy, we introduce a correction for the surface intrinsic error corresponding to an exchange correlation functional using the scheme implemented by Mattsson et al (2006 Phys. Rev. B 73 195123) and compare the effectiveness of the correction scheme for Al and the 3d transition metals.
Tejero, Ismael; Gonzalez-García, Núria; Gonzalez-Lafont, Angels; Lluch, José M
2007-05-09
The catechol functionality present in the catechins is responsible for the protective effects exerted by green tea against a wide range of human diseases. High-level electronic structure calculations and canonical variational transition-state theory including multidimensional tunneling corrections have allowed us to understand the key factors of the antioxidant effectiveness of the catechol group. This catechol group forms two hydrogen bonds with the two oxygen atoms of the lipid peroxyl radical, leading to a very compact reactant complex. This fact produces an extremely narrow adiabatic potential-energy profile corresponding to the hydrogen abstraction by the peroxyl radical, which makes it possible for a huge tunneling contribution to take place. So, quantum-mechanical tunneling highly increases the corresponding rate constant value, in such a way that catechins become able to trap the lipid peroxyl radicals in a dominant competition with the very damaging free-radical chain-lipid peroxidation reaction.
The origin of magnetism in transition metal-doped ZrO2 thin films: Experiment and theory
Hong, Nguyenhoa
2013-10-04
We have investigated the magnetic properties of Fe/Co/Ni-doped ZrO 2 laser ablated thin films in comparison with the known results of Mn-doped ZrO2, which is thought to be a promising material for spintronics applications. It is found that doping with a transition metal can induce room temperature ferromagnetism in \\'fake\\' diamond. Theoretical analysis based on density functional theory confirms the experimental measurements, by revealing that the magnetic moments of Mn- and Ni-doped ZrO2 thin films are much larger than that of Fe- or Co-doped ZrO2 thin films. Most importantly, our calculations confirm that Mn- and Ni-doped ZrO2 show a ferromagnetic ground state in comparison to Co- and Fe-doped ZrO 2, which favor an antiferromagnetic ground state. © 2013 IOP Publishing Ltd.
Epigenetic game theory: How to compute the epigenetic control of maternal-to-zygotic transition
Wang, Qian; Gosik, Kirk; Xing, Sujuan; Jiang, Libo; Sun, Lidan; Chinchilli, Vernon M.; Wu, Rongling
2017-03-01
Epigenetic reprogramming is thought to play a critical role in maintaining the normal development of embryos. How the methylation state of paternal and maternal genomes regulates embryogenesis depends on the interaction and coordination of the gametes of two sexes. While there is abundant research in exploring the epigenetic interactions of sperms and oocytes, a knowledge gap exists in the mechanistic quantitation of these interactions and their impact on embryo development. This review aims at formulating a modeling framework to address this gap through the integration and synthesis of evolutionary game theory and the latest discoveries of the epigenetic control of embryo development by next-generation sequencing. This framework, named epigenetic game theory or epiGame, views embryogenesis as an ecological system in which two highly distinct and specialized gametes coordinate through either cooperation or competition, or both, to maximize the fitness of embryos under Darwinian selection. By implementing a system of ordinary differential equations, epiGame quantifies the pattern and relative magnitude of the methylation effects on embryogenesis by the mechanisms of cooperation and competition. epiGame may gain new insight into reproductive biology and can be potentially applied to design personalized medicines for genetic disorder intervention.
Epigenetic game theory: How to compute the epigenetic control of maternal-to-zygotic transition.
Wang, Qian; Gosik, Kirk; Xing, Sujuan; Jiang, Libo; Sun, Lidan; Chinchilli, Vernon M; Wu, Rongling
2017-03-01
Epigenetic reprogramming is thought to play a critical role in maintaining the normal development of embryos. How the methylation state of paternal and maternal genomes regulates embryogenesis depends on the interaction and coordination of the gametes of two sexes. While there is abundant research in exploring the epigenetic interactions of sperms and oocytes, a knowledge gap exists in the mechanistic quantitation of these interactions and their impact on embryo development. This review aims at formulating a modeling framework to address this gap through the integration and synthesis of evolutionary game theory and the latest discoveries of the epigenetic control of embryo development by next-generation sequencing. This framework, named epigenetic game theory or epiGame, views embryogenesis as an ecological system in which two highly distinct and specialized gametes coordinate through either cooperation or competition, or both, to maximize the fitness of embryos under Darwinian selection. By implementing a system of ordinary differential equations, epiGame quantifies the pattern and relative magnitude of the methylation effects on embryogenesis by the mechanisms of cooperation and competition. epiGame may gain new insight into reproductive biology and can be potentially applied to design personalized medicines for genetic disorder intervention. Copyright © 2016 Elsevier B.V. All rights reserved.
Matheson, Lauren; Boulton, Mary; Lavender, Verna; Collins, Graham; Mitchell-Floyd, Tracy; Watson, Eila
2016-09-01
To explore the experiences of young adults with Hodgkin lymphoma during the first year following the end of initial treatment. . A qualitative grounded theory study. . Interviews with patients recruited from three cancer centers in England. . 10 Hodgkin lymphoma survivors (four men and six women aged 21-39 years) recruited as part of a larger study of 28 young adult cancer survivors. . Semistructured interviews were conducted about two months after treatment completion, and follow-up interviews were conducted seven months later. The authors' grounded theory of positive psychosocial adjustment to cancer provided the conceptual framework. . Positive reframing, informal peer support, acceptance, and normalization helped young adults dismantle the threats of Hodgkin lymphoma during the course of treatment. However, they described losing a sense of security following treatment completion. Greater age-specific information to enable better preparation for the future was desired regarding body image, fertility, sexual relationships, work, and socializing. . Informal support mechanisms, like peer support and patient navigator interventions, may be useful ways to further support young adults after treatment completion. . Positive psychosocial adjustment to cancer survivorship in young adults is facilitated by having informal peer support; being able to positively reframe, accept, and normalize their experience; and being prepared for the future.
Goodpaster, Jason D; Barnes, Taylor A; Manby, Frederick R; Miller, Thomas F
2012-12-14
Density functional theory (DFT) embedding provides a formally exact framework for interfacing correlated wave-function theory (WFT) methods with lower-level descriptions of electronic structure. Here, we report techniques to improve the accuracy and stability of WFT-in-DFT embedding calculations. In particular, we develop spin-dependent embedding potentials in both restricted and unrestricted orbital formulations to enable WFT-in-DFT embedding for open-shell systems, and develop an orbital-occupation-freezing technique to improve the convergence of optimized effective potential calculations that arise in the evaluation of the embedding potential. The new techniques are demonstrated in applications to the van-der-Waals-bound ethylene-propylene dimer and to the hexa-aquairon(II) transition-metal cation. Calculation of the dissociation curve for the ethylene-propylene dimer reveals that WFT-in-DFT embedding reproduces full CCSD(T) energies to within 0.1 kcal/mol at all distances, eliminating errors in the dispersion interactions due to conventional exchange-correlation (XC) functionals while simultaneously avoiding errors due to subsystem partitioning across covalent bonds. Application of WFT-in-DFT embedding to the calculation of the low-spin/high-spin splitting energy in the hexaaquairon(II) cation reveals that the majority of the dependence on the DFT XC functional can be eliminated by treating only the single transition-metal atom at the WFT level; furthermore, these calculations demonstrate the substantial effects of open-shell contributions to the embedding potential, and they suggest that restricted open-shell WFT-in-DFT embedding provides better accuracy than unrestricted open-shell WFT-in-DFT embedding due to the removal of spin contamination.
High pressure phase transitions in Mg{sub 1-x}Ca{sub x}O: Theory
Energy Technology Data Exchange (ETDEWEB)
Srivastava, Anurag; Chauhan, Mamta [Advanced Material Research Lab, Indian Institute of Information Technology and Management, Gwalior (India); Singh, R.K. [Department of Physics, ITM University, Gurgaon (India); Padegaonker, Rishikesh [Indian Embassy School, Sana (Yemen)
2011-08-15
We have analysed a B1 {yields} B2 structural phase transitions in Mg{sub 1-x}Ca{sub x}O solid solutions and their ground state properties by using first principle density functional theory and charge transfer interaction potential (CTIP) approach. The effects of exchange-correlation interactions are handled by the generalized gradient approximation with Perdew-Burke-Ernzerhof type parameterization. CTIP approach includes the long range modified Coulomb with charge transfer interactions and short range part of this model includes the van der Waals as well as Hafemeister Flygare type overlap repulsive interactions. The study observes a linear variation of calculated transition pressure, bulk modulus and lattice parameter of Mg{sub 1-x}Ca{sub x}O as a function of Ca composition. The observed results for the end point members are in agreement to their experimental counterparts and the deviations have been discussed. (Copyright copyright 2011 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)
Arnold, Thorsten; Siegmund, Marc; Pankratov, Oleg
2011-08-24
We apply exact-exchange spin-density functional theory in the Krieger-Li-Iafrate approximation to interacting electrons in quantum rings of different widths. The rings are threaded by a magnetic flux that induces a persistent current. A weak space and spin symmetry breaking potential is introduced to allow for localized solutions. As the electron-electron interaction strength described by the dimensionless parameter r(S) is increased, we observe-at a fixed spin magnetic moment-the subsequent transition of both spin sub-systems from the Fermi liquid to the Wigner crystal state. A dramatic signature of Wigner crystallization is that the persistent current drops sharply with increasing r(S). We observe simultaneously the emergence of pronounced oscillations in the spin-resolved densities and in the electron localization functions indicating a spatial electron localization showing ferrimagnetic order after both spin sub-systems have undergone the Wigner crystallization. The critical r(S)(c) at the transition point is substantially smaller than in a fully spin-polarized system and decreases further with decreasing ring width. Relaxing the constraint of a fixed spin magnetic moment, we find that on increasing r(S) the stable phase changes from an unpolarized Fermi liquid to an antiferromagnetic Wigner crystal and finally to a fully polarized Fermi liquid. © 2011 IOP Publishing Ltd
International Nuclear Information System (INIS)
Keskin, Mustafa; Canko, Osman
2005-01-01
The relaxation behavior of the spin-3/2 Ising model Hamiltonian with bilinear and biquadratic interactions near the second-order phase transition temperature or critical temperature is studied by means of the Onsager's theory of irreversible thermodynamics or the Onsager reciprocity theorem (ORT). First, we give the equilibrium case briefly within the molecular-field approximation in order to study the relaxation behavior by using the ORT. Then, the ORT is applied to the model and the kinetic equations are obtained. By solving these equations, three relaxation times are calculated and examined for temperatures near the second-order phase transition temperature. It is found that one of the relaxation times goes to infinity near the critical temperature on either side, the second relaxation time makes a cusp at the critical temperature and third one behaves very differently in which it terminates at the critical temperature while approaching it, then showing a 'flatness' property and then decreases. We also study the influences of the Onsager rate coefficients on the relaxation times. The behavior of these relaxation times is discussed and compared with the spin-1/2 and spin-1 Ising systems
International Nuclear Information System (INIS)
Banacky, P.
2010-01-01
Complex electronic ground state of molecular and solid state system is analyzed on the ab initio level beyond the adiabatic Born-Oppenheimer approximation (BOA). The attention is focused on the band structure fluctuation (BSF) at Fermi level, which is induced by electron-phonon coupling in superconductors, and which is absent in the non-superconducting analogues. The BSF in superconductors results in breakdown of the adiabatic BOA. At these circumstances, chemical potential is substantially reduced and system is stabilized (effect of nuclear dynamics) in the anti adiabatic state at broken symmetry with a gap(s) in one-particle spectrum. Distorted nuclear structure has fluxional character and geometric degeneracy of the anti adiabatic ground state enables formation of mobile bipolarons in real space. It has been shown that an effective attractive e-e interaction (Cooper-pair formation) is in fact correction to electron correlation energy at transition from adiabatic into anti adiabatic ground electronic state. In this respect, Cooper-pair formation is not the primary reason for transition into superconducting state, but it is a consequence of anti adiabatic state formation. It has been shown that thermodynamic properties of system in anti adiabatic state correspond to thermodynamics of superconducting state. Illustrative application of the theory for different types of superconductors is presented.
Zhang, Yufeng; Long, Man; Luo, Sida; Bao, Yu; Shen, Hanxia
2015-12-01
Transit route choice model is the key technology of public transit systems planning and management. Traditional route choice models are mostly based on expected utility theory which has an evident shortcoming that it cannot accurately portray travelers' subjective route choice behavior for their risk preferences are not taken into consideration. Cumulative prospect theory (CPT), a brand new theory, can be used to describe travelers' decision-making process under the condition of uncertainty of transit supply and risk preferences of multi-type travelers. The method to calibrate the reference point, a key parameter to CPT-based transit route choice model, determines the precision of the model to a great extent. In this paper, a new method is put forward to obtain the value of reference point which combines theoretical calculation and field investigation results. Comparing the proposed method with traditional method, it shows that the new method can promote the quality of CPT-based model by improving the accuracy in simulating travelers' route choice behaviors based on transit trip investigation from Nanjing City, China. The proposed method is of great significance to logical transit planning and management, and to some extent makes up the defect that obtaining the reference point is solely based on qualitative analysis.
DEFF Research Database (Denmark)
Schmidt, Per Simmendefeldt; Thygesen, Kristian Sommer
2018-01-01
(RPA) is found to yield high accuracy for both adsorption and surface energies. In contrast, all the considered density functionals fail to describe both quantities accurately. This establishes the RPA as a universally accurate method for surface science. In the second part, we use the RPA to construct...... be significant. RPA is compared to the more advanced renormalized adiabatic LDA (rALDA) method for a subset of the reactions, and they are found to describe the adsorbate-metal bond as well as adsorbate-adsorbate interactions similarly. The RPA results are compared to a range of standard density functional...... theory methods typically employed for surface reactions representing the various rungs on Jacob's ladder. The deviations are found to be highly functional, surface, and reaction dependent. Our work establishes the RPA and rALDA methods as universally accurate full ab initio methods for surface science...
Directory of Open Access Journals (Sweden)
Pablo Castagno
2012-05-01
Full Text Available This article contends that for socialist emancipation to occur it is crucial to investigate how political cadres conceal, regulate or displace the demands of citizens and workers in the context of the calamitous effects of global capitalism. Analyzing the constitutive relationship between politics and the media is an essential component in researching those practices of state ideological production. Specifically looking into the transformation of media policy in the case of Argentina, this article problematizes the different political forms through which the state has cloaked its fundamental contradiction: alleged representation of the general interests of citizens, when explored in critical depth, reveals the state’s actual adjustment to a process of capitalist transnationalization that increases irrationality, social inequality and misery. Through this lens, the article emphasizes the value of Marxist dialectic method and theory in imagining a true democratic future.
Ginzburg-Landau theory and the superconducting transition in thin, amorphous bismuth films
International Nuclear Information System (INIS)
Van Vechten, D.
1979-01-01
The Aslamasov-Larkin (AL) theory can be derived from a classical treatment of the conductivity due to short-lived statistical fluctuations into the superconducting state if one truncates the Ginzburg-Landau free energy density expression to read F[psi] = α 0 vertical barpsi vertical bar 2 + c 0 vertical bar del psi vertical bar 2 , where psi is the superconducting order parameter. The next largest term in the GL free energy is (b/2) (vertical bar psi vertical bar 2 ) 2 and is conventionally interpreted as representing the energy associated with interactions between the fluctuations. My dissertation consists of the calculation of the effect of this term on the fluctuation conductivity in three different approximations and the comparison of my predictions to the data of R.E. Glover III and M.K. Chien on thin amorphous bismuth films. The first approximation calculates the contribution to the fluctuations' self energy of the ''tadpole'' diagrams. This approximation yields a 4 parameter equation. Its fits were particularly outstanding for the films deposited on quartz or roughened glass substrates and only for two smooth glass substrates were there non-isolated data points that were not fit at the lowest temperatures measured. (The equation runs into trouble for these films at approximately R(T)/R/sub o/ =.08.) The values of the theoretical equation's fitting parameters were determined by a least squares method and turns out to depend on film thickness in the manner predicted by the theory. The next calculation improves the self energy approximation by including all the ''ring'' diagrams
2013-01-01
Background Transitioning to parenthood is a major life event that may impact parents’ personal lifestyles, yet there is an absence of theory-based research examining the impact of parenthood on motives for dietary behaviour. As a result, we are unaware of the social cognitive variables that predict eating behaviour among those transitioning to parenthood. The purpose of the study was to examine eating behaviour motives across 12 months within the framework of the theory of planned behavior (TPB) and compare these across groups of new parents, non-parents, and established parents. Methods Non-parents (n = 92), new parents (n = 135), and established parents (n = 71) completed TPB questionnaires assessing attitudes, subjective norms, perceived behavioral control (PBC), and intentions and three day food records at baseline, and 6- and 12-months post-delivery (for parents) and 6- and 12-months post-baseline (for non-parents). Results Repeated measures ANOVAs revealed that among men, new- and established-parents had greater intentions to eat healthy compared to non-parents, F(2) = 3.59, p = .03. Among women, established parents had greater intentions than new- and non-parents, F(2) = 5.33, p = .01. Among both men and women during the first 6-months post-delivery, new-parents experienced decreased PBC, whereas established parents experienced increased PBC. Overall, affective attitudes were the strongest predictor of intentions for men (β = 0.55, p < .001) and women (β = 0.38, p < .01). PBC predicted changes in fruit and vegetable consumption for men (β = 0.45, p = .02), and changes in fat consumption for men (β = −0.25, p = .03) and women (β = −.24, p < .05), regardless of parent status. Conclusion The transition to parenthood for new and established parents may impact motivation for healthy eating, especially PBC within the framework of TPB. However, regardless of parental status, affective
Li, Yi
It is of great scientific significance to study the complex systems of agents with adaptive strategies competing for resources. In many of such systems in social and biological environments, agents succeed by making innovative choices. In this thesis, we model this behavior by presenting the results and analysis of a class of games in which heterogeneous agents are rewarded for being in a minority group. Each agent possesses a number of fixed strategies, each of which takes publicly available information as input to predict next group. Commonly known as the minority game, this simple model manifests a maladaptive, informationally efficient phase in which the system performs poorly at generating resources and an inefficient phase in which there is an emergent cooperation among the agents, and the system more effectively generates resources. The best emergent coordination is achieved at the phase transition, which occurs when z, the ratio of the dimension of the strategy space to the number of agents, is about 0.34. This model also has similar properties to a spin glass system thus statistical mechanics methods were employed to provide analytical results. The phase structure persists under variations such as variable payoff schemes and evolutionary mechanisms. Agents in real life are subject to local connectivity and incomplete information. A framework based on bi-graph was proposed to model these factors. In the context of economics, we proposed a stock market model incorporating delayed majority dynamics and agents holding heterogeneous expectations. We found that for a range of parameter settings, minority dynamics are dynamically induced, effectively reducing market volatility. Finally, we introduce a version of the minority game played by human participants. We observed emergent coordination of players' choices leading to increased average reward. Furthermore, players with the simplest strategies reap the most wealth.
Crossover behavior of the thermal conductance and Kramers’ transition rate theory
Velizhanin, Kirill A.; Sahu, Subin; Chien, Chih-Chun; Dubi, Yonatan; Zwolak, Michael
2015-12-01
Kramers’ theory frames chemical reaction rates in solution as reactants overcoming a barrier in the presence of friction and noise. For weak coupling to the solution, the reaction rate is limited by the rate at which the solution can restore equilibrium after a subset of reactants have surmounted the barrier to become products. For strong coupling, there are always sufficiently energetic reactants. However, the solution returns many of the intermediate states back to the reactants before the product fully forms. Here, we demonstrate that the thermal conductance displays an analogous physical response to the friction and noise that drive the heat current through a material or structure. A crossover behavior emerges where the thermal reservoirs dominate the conductance at the extremes and only in the intermediate region are the intrinsic properties of the lattice manifest. Not only does this shed new light on Kramers’ classic turnover problem, this result is significant for the design of devices for thermal management and other applications, as well as the proper simulation of transport at the nanoscale.
Energy Technology Data Exchange (ETDEWEB)
Nakata, Hidehiko [Waseda Univ., Tokyo (Japan). Dept. of Physics; Tachibana, Takahiro; Yamada, Masami
1997-03-01
Recently the gross theory of nuclear {beta}-decay was refined for odd-odd nuclei. In this refinement, the effect of the selection rule of {beta}-transitions from the ground states of odd-odd nuclei to those of even-even nuclei was taken into account based on a statistical consideration. The transitions to the first 2{sup +} excited states in even-even nuclei were also taken into account according to the selection rule approximately. In that study, it was found that the transitions between 1{sup -} ground states of the odd-odd nuclei and 0{sup +} ground states of even-even nuclei, belonging to the first-forbidden transitions of rank 1, are strongly hindered. A reduction factor was introduced for the transitions to the ground states of even-even nuclei to take into account this hindrance. It was also found that the strength functions of the Gamow-Teller transitions obtained from the conventional gross theory are underestimated by a factor of about 3. In order to improve this underestimation, the Lorentz-type function was adopted for the one-particle strength function in the model instead of the hyperbolic-secant-type function. In the present study we have newly analyzed the experimental ft-values of odd-A nuclei, and found that the first-forbidden transitions of rank 1 are also considerably hindered between the ground states. Following the above refinement we have calculated the {beta}-ray spectra of some odd-odd short-lived fission products with the use of the refined gross theory. These results are compared not only with the experiments by Rudstam et al. but also with the conventional gross theory. (author)
Starr, Francis W; Douglas, Jack F; Sastry, Srikanth
2013-03-28
We carefully examine common measures of dynamical heterogeneity for a model polymer melt and test how these scales compare with those hypothesized by the Adam and Gibbs (AG) and random first-order transition (RFOT) theories of relaxation in glass-forming liquids. To this end, we first analyze clusters of highly mobile particles, the string-like collective motion of these mobile particles, and clusters of relative low mobility. We show that the time scale of the high-mobility clusters and strings is associated with a diffusive time scale, while the low-mobility particles' time scale relates to a structural relaxation time. The difference of the characteristic times for the high- and low-mobility particles naturally explains the well-known decoupling of diffusion and structural relaxation time scales. Despite the inherent difference of dynamics between high- and low-mobility particles, we find a high degree of similarity in the geometrical structure of these particle clusters. In particular, we show that the fractal dimensions of these clusters are consistent with those of swollen branched polymers or branched polymers with screened excluded-volume interactions, corresponding to lattice animals and percolation clusters, respectively. In contrast, the fractal dimension of the strings crosses over from that of self-avoiding walks for small strings, to simple random walks for longer, more strongly interacting, strings, corresponding to flexible polymers with screened excluded-volume interactions. We examine the appropriateness of identifying the size scales of either mobile particle clusters or strings with the size of cooperatively rearranging regions (CRR) in the AG and RFOT theories. We find that the string size appears to be the most consistent measure of CRR for both the AG and RFOT models. Identifying strings or clusters with the "mosaic" length of the RFOT model relaxes the conventional assumption that the "entropic droplets" are compact. We also confirm the
Energy Technology Data Exchange (ETDEWEB)
Shamim, Md; Harbola, Manoj K, E-mail: sami@iitk.ac.i, E-mail: mkh@iitk.ac.i [Department of Physics, Indian Institute of Technology, Kanpur 208 016 (India)
2010-11-14
Transition energies of a new class of excited states (two-gap systems) of various atoms are calculated in time-independent density functional formalism by using a recently proposed local density approximation exchange energy functional for excited states. It is shown that the excitation energies calculated with this functional compare well with those calculated with exact exchange theories.
International Nuclear Information System (INIS)
Shamim, Md; Harbola, Manoj K
2010-01-01
Transition energies of a new class of excited states (two-gap systems) of various atoms are calculated in time-independent density functional formalism by using a recently proposed local density approximation exchange energy functional for excited states. It is shown that the excitation energies calculated with this functional compare well with those calculated with exact exchange theories.
Najafi Ghezeljeh, Tahereh; Yadavar Nikravesh, Mansoureh; Emami, Azita
2014-02-01
To explore how Iranian patients with coronary heart disease experience their lives. Coronary heart disease is a leading cause of death in Iran and worldwide. Understanding qualitatively how patients experience the acute and postacute stages of this chronic condition is essential knowledge for minimising the negative consequences of coronary heart disease. Qualitative study using grounded theory for the data analysis. Data for this study were collected through individual qualitative interviews with 24 patients with coronary heart disease, conducted between January 2009 and January 2011. Patients with angina pectoris were selected for participation through purposive sampling, and sample size was determined by data saturation. Data analysis began with initial coding and continued with focused coding. Categories were determined, and the core category was subsequently developed and finalised. The main categories of the transition from acute phase to a modified or 'new normal' life were: (1) Loss of normal life. Experiencing emotions and consequences of illness; (2) Coming to terms. Using coping strategies; (3) Recreating normal life. Healthcare providers must correctly recognise the stages of transition patients navigate while coping with coronary heart disease to support and educate them appropriately throughout these stages. Patients with coronary heart disease lose their normal lives and must work towards recreating a revised life using coping strategies that enable them to come to terms with their situations. By understanding Iranian patients' experiences, healthcare providers and especially nurses can use the information to support and educate patients with coronary heart disease on how to more effectively deal with their illness and its consequences. © 2013 John Wiley & Sons Ltd.
Bassett-Gunter, Rebecca L; Levy-Milne, Ryna; Naylor, Patti Jean; Symons Downs, Danielle; Benoit, Cecilia; Warburton, Darren E R; Blanchard, Chris M; Rhodes, Ryan E
2013-07-06
Transitioning to parenthood is a major life event that may impact parents' personal lifestyles, yet there is an absence of theory-based research examining the impact of parenthood on motives for dietary behaviour. As a result, we are unaware of the social cognitive variables that predict eating behaviour among those transitioning to parenthood. The purpose of the study was to examine eating behaviour motives across 12 months within the framework of the theory of planned behavior (TPB) and compare these across groups of new parents, non-parents, and established parents. Non-parents (n = 92), new parents (n = 135), and established parents (n = 71) completed TPB questionnaires assessing attitudes, subjective norms, perceived behavioral control (PBC), and intentions and three day food records at baseline, and 6- and 12-months post-delivery (for parents) and 6- and 12-months post-baseline (for non-parents). Repeated measures ANOVAs revealed that among men, new- and established-parents had greater intentions to eat healthy compared to non-parents, F(2) = 3.59, p = .03. Among women, established parents had greater intentions than new- and non-parents, F(2) = 5.33, p = .01. Among both men and women during the first 6-months post-delivery, new-parents experienced decreased PBC, whereas established parents experienced increased PBC. Overall, affective attitudes were the strongest predictor of intentions for men (β = 0.55, p changes in fruit and vegetable consumption for men (β = 0.45, p = .02), and changes in fat consumption for men (β = -0.25, p = .03) and women (β = -.24, p motivation for healthy eating, especially PBC within the framework of TPB. However, regardless of parental status, affective attitudes and PBC are critical antecedents of intentions and eating behaviour. Interventions should target affective attitudes and PBC to motivate healthy eating and may need to be intensified during parenthood.
International Nuclear Information System (INIS)
Sharma, R.R.
2006-01-01
First temperature dependent regular and pseudo-energy gap parameters and regular and pseudo-transition temperatures arising from the same physical origin have been calculated in the strong coupling formalism. Temperature dependent many-body field-theoretic techniques have been developed, as an extension of our previous zero-temperature formalism, to derive temperature dependent general expressions for the renormalized energy gap parameter Δ(k->,ω), the gap renormalization parameter Z(k->,ω) and energy band renormalization parameter χ(k->,ω) for momentum k-> and frequency ω making use of dipolon propagator and electron Green's function taking into account explicitly the dressed dipolons as mediators of superconductivity, the screened Coulomb repulsion and nonrigid electron energy bands considering retardation and damping effects and electron-hole asymmetry. The theory takes into account all necessary and important correlations. Our self-consistent calculations utilize the previously symmetry predicted two energy gap parameters for superconducting cuprates, one being antisymmetric (''as'') with respect to the exchange of the k x and k y components of vector k-> and the other being symmetric (''s'') with respect to the exchange of k x and k y . Our present temperature dependent self-consistent solutions of the real and imaginary parts of the Δ(k->,ω), Z(k->,ω) and χ(k->,ω) confirm the existence of these two (different) solutions and conclude that the antisymmetric solution of the gap parameter corresponds to the observed regular (''reg'') superconducting energy gap whereas the symmetric solution corresponds to the observed pseudo-(''pse-'') energy gap. Explicit temperature dependent self-consistent calculations have been performed here for Bi 2 Sr 2 CaCu 2 O 8+δ as well as Bi 2 Sr 2 CaCu 2 O 8 giving temperature dependent energy gap parameters and corresponding transition temperatures. The calculated results are consistent with the available experimental
Jang, Seogjoo; Voth, Gregory A
2017-05-07
Despite the fact that quantum mechanical principles do not allow the establishment of an exact quantum analogue of the classical transition state theory (TST), the development of a quantum TST (QTST) with a proper dynamical justification, while recovering the TST in the classical limit, has been a long standing theoretical challenge in chemical physics. One of the most recent efforts of this kind was put forth by Hele and Althorpe (HA) [J. Chem. Phys. 138, 084108 (2013)], which can be specified for any cyclically invariant dividing surface defined in the space of the imaginary time path integral. The present work revisits the issue of the non-uniqueness of QTST and provides a detailed theoretical analysis of HA-QTST for a general class of such path integral dividing surfaces. While we confirm that HA-QTST reproduces the result based on the ring polymer molecular dynamics (RPMD) rate theory for dividing surfaces containing only a quadratic form of low frequency Fourier modes, we find that it produces different results for those containing higher frequency imaginary time paths which accommodate greater quantum fluctuations. This result confirms the assessment made in our previous work [Jang and Voth, J. Chem. Phys. 144, 084110 (2016)] that HA-QTST does not provide a derivation of RPMD-TST in general and points to a new ambiguity of HA-QTST with respect to its justification for general cyclically invariant dividing surfaces defined in the space of imaginary time path integrals. Our analysis also offers new insights into similar path integral based QTST approaches.
Beacom, Amy Maureen
2013-01-01
Today, women comprise nearly half the U.S. workforce and outnumber men in many previously male-dominated fields. This seismic cultural and demographic shift has dramatically impacted organizations. The most obvious impact is the presence of, and dependence on, increased numbers of women employees throughout organizations. Retention of talented…
Energy Technology Data Exchange (ETDEWEB)
Burrola-Gándara, L. A., E-mail: andres.burrola@gmail.com; Santillan-Rodriguez, C. R.; Rivera-Gomez, F. J.; Saenz-Hernandez, R. J.; Botello-Zubiate, M. E.; Matutes-Aquino, J. A. [Departamento de Física de Materiales, Centro de Investigación en Materiales Avanzados, S.C., Miguel de Cervantes 120, Complejo Industrial Chihuahua, Chihuahua 31109 (Mexico)
2015-05-07
Magnetocaloric materials with second order phase transition near the Curie temperature can be described by critical phenomena theory. In this theory, scaling, universality, and renormalization are key concepts from which several phase transition order criteria are derived. In this work, the rescaled universal curve, Banerjee and mean field theory criteria were used to make a comparison for several magnetocaloric materials including pure Gd, SmCo{sub 1.8}Fe{sub 0.2}, MnFeP{sub 0.46}As{sub 0.54}, and La{sub 0.7}Ca{sub 0.15}Sr{sub 0.15}MnO{sub 3}. Pure Gd, SmCo{sub 1.8}Fe{sub 0.2}, and La{sub 0.7}Ca{sub 0.15}Sr{sub 0.15}MnO{sub 3} present a collapse of the rescaled magnetic entropy change curves into a universal curve, which indicates a second order phase transition; applying Banerjee criterion to H/σ vs σ{sup 2} Arrot plots and the mean field theory relation |ΔS{sub M}| ∝ (μ{sub 0}H/T{sub c}){sup 2/3} for the same materials also determines a second order phase transition. However, in the MnFeP{sub 0.46}As{sub 0.54} sample, the Banerjee criterion applied to the H/σ vs σ{sup 2} Arrot plot indicates a first order magnetic phase transition, while the mean field theory prediction for a second order phase transition, |ΔS{sub M}| ∝ (μ{sub 0}H/T{sub c}){sup 2/3}, describes a second order behavior. Also, a mixture of first and second order behavior was indicated by the rescaled universal curve criterion. The diverse results obtained for each criterion in MnFeP{sub 0.46}As{sub 0.54} are apparently related to the magnetoelastic effect and to the simultaneous presence of weak and strong magnetism in Fe (3f) and Mn (3g) alternate atomic layers, respectively. The simultaneous application of the universal curve, the Banerjee and the mean field theory criteria has allowed a better understanding about the nature of the order of the phase transitions in different magnetocaloric materials.
Bhatnagar, Gaurav; Chatterjee, Sayantan; Chapman, Walter G.; Dugan, Brandon; Dickens, Gerald R.; Hirasaki, George J.
2011-03-01
We develop a theory that relates gas hydrate saturation in marine sediments to the depth of the sulfate-methane transition (SMT) zone below the seafloor using steady state, analytical expressions. These expressions are valid for systems in which all methane transported into the gas hydrate stability zone (GHSZ) comes from deeper external sources (i.e., advective systems). This advective constraint causes anaerobic oxidation of methane to be the only sulfate sink, allowing us to link SMT depth to net methane flux. We also develop analytical expressions that define the gas hydrate saturation profile based on SMT depth and site-specific parameters such as sedimentation rate, methane solubility, and porosity. We evaluate our analytical model at four drill sites along the Cascadia Margin where methane sources from depth dominate. With our model, we calculate average gas hydrate saturations across GHSZ and the top occurrence of gas hydrate at these sites as 0.4% and 120 mbsf (Site 889), 1.9% and 70 mbsf (Site U1325), 4.7% and 40 mbsf (Site U1326), and 0% (Site U1329), mbsf being meters below seafloor. These values compare favorably with average saturations and top occurrences computed from resistivity log and chloride data. The analytical expressions thus provide a fast and convenient method to calculate gas hydrate saturation and first-order occurrence at a given geologic setting where vertically upward advection dominates the methane flux.
Greene, Samuel M; Shan, Xiao; Clary, David C
2015-12-17
Quantum mechanical methods for calculating rate constants are often intractable for reactions involving many atoms. Semiclassical transition state theory (SCTST) offers computational advantages over these methods but nonetheless scales exponentially with the number of degrees of freedom (DOFs) of the system. Here we present a method with more favorable scaling, reduced-dimensionality SCTST (RD SCTST), that treats only a subset of DOFs of the system explicitly. We apply it to three H abstraction and exchange reactions for which two-dimensional potential energy surfaces (PESs) have previously been constructed and evaluated using RD quantum scattering calculations. We differentiated these PESs to calculate harmonic frequencies and anharmonic constants, which were then used to calculate cumulative reaction probabilities and rate constants by RD SCTST. This method yielded rate constants in good agreement with quantum scattering results. Notably, it performed well for a heavy-light-heavy reaction, even though it does not explicitly account for corner-cutting effects. Recent extensions to SCTST that improve its treatment of deep tunneling were also evaluated within the reduced-dimensionality framework. The success of RD SCTST in this study suggests its potential applicability to larger systems.
Ueda, Shigenori; Hamada, Ikutaro
2017-12-01
The X-ray polarization dependent valence band HAXPES spectra of 3d transition metals (TMs) of Ti-Zn were measured to investigate the orbital resolved electronic structures by utilizing that the fact the photoionization cross-section of the atomic orbitals strongly depends on the experimental geometry. We have calculated the HAXPES spectra, which correspond to the cross-section weighted densities of states (CSW-DOSs), where the DOSs were obtained by the density functional theory calculations, and we have determined the relative photoionization cross-sections of the 4s and 4p orbitals to the 3d orbital in the 3d TMs. The experimentally obtained bulk-sensitive 3d and 4s DOSs were good agreement with the calculated DOSs in Ti, V, Cr, and Cu. In contrast, the deviations between the experimental and calculated 3d DOSs for Mn, Fe, Co, Ni were found, suggesting that the electron correlation plays an important role in the electronic structures for these materials.
Robertson, Heather-Jane
2000-01-01
Demographic projections concerning the shortage of teachers in Canada, their pay scale, the feminization of teaching, the gender gap in salaries, and teacher autonomy have often been incorrect, or correct for the wrong reasons. Instead of relying on demographic predictions, teachers should contemplate who they really want to be professionally,…
Rasiah, Velu; Armour, John David
2013-02-15
Reliable information in transit time (TT) derived from transit velocity (TV) for rain or irrigation water to mix with groundwater (GW) and the subsequent discharge to surface water bodies (SWB) is essential to address the issues associated with the transport of nutrients, particularly nitrate, from GW to SWB. The objectives of this study are to (i) compare the TV estimates obtained using flux theory-based (FT) approach with the water table rise/recession (WT) rate approach and (ii) explore the impact of the differences on solute transport from GW to SWB. The results from a study conducted during two rainy seasons in the northeast humid tropics of Queensland, Australia, showed the TV varied in space and over time and the variations depended on the estimation procedures. The lateral TV computed using the WT approach ranged from 1.00 × 10(-3) to 2.82 × 10(-1) m/d with a mean of 6.18 × 10(-2) m/d compared with 2.90 × 10(-4) to 5.15 × 10(-2) m/d for FT with a mean of 2.63 × 10(-2) m/d. The vertical TV ranged from 2.00 × 10(-3) to 6.02 × 10(-1) m/d with a mean of 1.28 × 10(-1) m/d for the WT compared with 6.76 × 10(-3)-1.78 m/d for the FT with a mean of 2.73 × 10(-1) m/d. These differences are attributed to the role played by different flow pathways. The bypass flow pathway played a role only in WT but not in FT. Approximately 86-95% of the variability in lateral solute transport was accounted for by the lateral TV and the total recession between two consecutive major rainfall events. A comparison of TT from FT and WT approaches indicated the laterally transported nitrate from the GW to the nearby creek was relatively 'new', implying the opportunity for accumulation and to undergo biochemical reactions in GW was low. The results indicated the WT approach produced more reliable TT estimates than FT in the presence of bypass flow pathways. Copyright © 2012 Elsevier Ltd. All rights reserved.
Directory of Open Access Journals (Sweden)
Ding Liu
2014-01-01
Full Text Available This paper explores the impact of prospect theory based commuter’s residential location choice on the design problem of a rail transit line located in a monocentric city. A closed-form social welfare maximization model is proposed, with special consideration given to prospect theory based commuter’s residential location choice over years. Commuters are assumed to make residential location choice by a trade-off between daily housing rent and generalized travel cost to minimize their prospect values. The solutions properties of the proposed model are explored and compared analytically. It is found that overestimation exists for the optimal solutions of rail line length, headway, and fare based on traditional utility theory, compared with the optimal solutions of the proposed prospect theory based model. A numerical example is given to illustrate the properties of the proposed model.
[Recent demographic trends in Turkey].
Behar, C
1993-01-01
, contraceptive usage, and other indicators. Turkey thus appears to be divided into a region in which the demographic transition is well advanced and one where it is proceeding more slowly.
Rudin, M; Beckmann, N; Sauter, A
1997-01-01
Determination of tissue perfusion rates by MRI bolus tracking methods relies on the central volume principle which states that tissue blood flow is given by the tissue blood volume divided by the mean tracer transit time (MTT). Accurate determination of the MTT requires knowledge of the arterial input function which in MRI experiments is usually not known, especially when using small animals. The problem of unknown arterial input can be circumvented in animal experiments by directly injecting the contrast agent into a feeding artery of the tissue of interest. In the present article the passage of magnetite nanoparticles through the rat cerebral cortex is analyzed after injection into the internal carotid artery. The results are discussed in the framework of linear system theory using a one-compartment model for brain tissue and by using the well characterized gamma-variate function to describe the tissue concentration profile of the contrast agent. The results obtained from the intra-arterial tracer administration experiments are then compared with the commonly used intra-venous injection of the contrast agent in order to estimate the contribution of the peripheral circulation to the MTT values in the latter case. The experiments were analyzed using a two-compartment model and the gamma-variate function. As an application perfusion rates in normal and ischemic cerebral cortex of hypertensive rats were estimated in a model of focal cerebral ischemia. The results indicate that peripheral circulation has a significant influence on the MTT values and thus on the perfusion rates, which cannot be neglected.
Ramírez-Anguita, Juan M; González-Lafont, Àngels; Lluch, José M
2011-07-30
The chemical tropospheric dimethyl sulfide (DMS, CH3SCH3) degradation involves several steps highly dependent on the environmental conditions. So, intensive efforts have been devoted during the last years to enhance the understanding of the DMS oxidation mechanism under different conditions. The reaction of DMS with OH is considered to be the most relevant process that initiates the whole oxidation process. The experimental observations have been explained by a two-channel mechanism consisting of a H-abstraction process leading to CH3S(O)CH3 and HO2 and an addition reaction leading to the DMS·OH adduct. In the presence of O2, the DMS·OH adduct is competitively scavenged increasing the contribution of the addition channel to the overall DMS oxidation. Recent experimental measurements have determined from a global fit that the rate constant of this scavenging process is independent of pressure and temperature but this rate constant cannot be directly measured. In this article, a variational transition-state theory calculation of the low- and high-pressure rate constants for the reaction between DMS·OH and O2 has been carried out as a function of temperature. Our proposal is that the slight temperature dependence of the scavenging rate constant can only be explained if the H-abstraction bottleneck is preceded by a dynamical bottleneck corresponding to the association process between the DMS·OH adduct and the O2 molecule. The agreement between the low-pressure and high-pressure rate constants confirms the experimental observations. Copyright © 2011 Wiley Periodicals, Inc.
Ishihara, Masamichi
2018-04-01
We studied the effects of nonextensivity on the phase transition for the system of finite volume V in the ϕ4 theory in the Tsallis nonextensive statistics of entropic parameter q and temperature T, when the deviation from the Boltzmann-Gibbs (BG) statistics, |q ‑ 1|, is small. We calculated the condensate and the effective mass to the order q ‑ 1 with the normalized q-expectation value under the free particle approximation with zero bare mass. The following facts were found. The condensate Φ divided by v, Φ/v, at q (v is the value of the condensate at T = 0) is smaller than that at q‧ for q > q‧ as a function of Tph/v which is the physical temperature Tph divided by v. The physical temperature Tph is related to the variation of the Tsallis entropy and the variation of the internal energies, and Tph at q = 1 coincides with T. The effective mass decreases, reaches minimum, and increases after that, as Tph increases. The effective mass at q > 1 is lighter than the effective mass at q = 1 at low physical temperature and heavier than the effective mass at q = 1 at high physical temperature. The effects of the nonextensivity on the physical quantity as a function of Tph become strong as |q ‑ 1| increases. The results indicate the significance of the definition of the expectation value, the definition of the physical temperature, and the constraints for the density operator, when the terms including the volume of the system are not negligible.
Laboratory Demographics Lookup Tool
U.S. Department of Health & Human Services — This website provides demographic information about laboratories, including CLIA number, facility name and address, where the laboratory testing is performed, the...
ROZMAINSKY I.V.
2016-01-01
The paper develops Post Keynesian theory of endogenous money and applies it to analysis of changes in monetary circulation in the Russian transitional economy in 1991-1998. These changes were characterized by displacement of bank deposits by cash, barter and inter-firm arrears as special means of payment. Author treats this process as «monetary degradation» because it created additional barriers to financing investment, made for criminalization and contributed to cost-push inflation. All this...
Lippke, Sonia; Plotnikoff, Ronald C
2009-05-01
Two different theories of health behaviour have been chosen with the aim of theory integration: a continuous theory (protection motivation theory, PMT) and a stage model (transtheoretical model, TTM). This is the first study to test whether the stages of the TTM moderate the interrelation of PMT-variables and the mediation of motivation, as well as PMT-variables' interactions in predicting stage transitions. Hypotheses were tested regarding (1) mean patterns, stage pair-comparisons and nonlinear trends using ANOVAs; (2) prediction-patterns for the different stage groups employing multi-group structural equation modelling (MSEM) and nested model analyses; and (3) stage transitions using binary logistic regression analyses. Adults (N=1,602) were assessed over a 6 month period on their physical activity stages, PMT-variables and subsequent behaviour. (1) Particular mean differences and nonlinear trends in all test variables were found. (2) The PMT adequately fitted the five stage groups. The MSEM revealed that covariances within threat appraisal and coping appraisal were invariant and all other constrains were stage-specific, i.e. stage was a moderator. Except for self-efficacy, motivation fully mediated the relationship between the social-cognitive variables and behaviour. (3) Predicting stage transitions with the PMT-variables underscored the importance of self-efficacy. Only when threat appraisal and coping appraisal were high, stage movement was more likely in the preparation stage. Results emphasize stage-specific differences of the PMT mechanisms, and hence, support the stage construct. The findings may guide further theory building and research integrating different theoretical approaches.
Okumu, Jacob O.
2014-01-01
This study explored college transition meaning-making dynamics of emancipated foster care youth and the role campus environments play in that process. It adds to the college student development theoretical base by acknowledging the needs, goals, and values of disenfranchised college students transitioning into higher education. Emancipated foster…
Hollingworth, Katie; Jackson, Sonia
2016-10-01
Coleman's focal theory, developed in relation to adolescents in the general population, appears to offer some explanation for the poor educational achievement and social exclusion of care leavers, but has been little tested empirically. This paper revisits data from two studies of care-experienced young people aged 18-25, drawing on qualitative interviews in the UK and four other European countries, to see if focal theory would have helped to predict their educational progression or otherwise. The lives of research participants were found to be characterised by disruptions and uncertainty, with multiple challenges confronting them in quick succession, making it hard for them to pace their transitions as, according to focal theory, other young people do. Findings suggest that the theory could be used to inform policy designed to improve educational outcomes and should be incorporated into training for those responsible for supporting care leavers through their transition to adulthood. Copyright © 2016 The Foundation for Professionals in Services for Adolescents. Published by Elsevier Ltd. All rights reserved.
Bieniek, M. S.; Santos, D. F. N.; Almeida, P. G. C.; Benilov, M. S.
2018-04-01
General scenarios of transitions between different spot patterns on electrodes of DC gas discharges and their relation to bifurcations of steady-state solutions are analyzed. In the case of cathodes of arc discharges, it is shown that any transition between different modes of current transfer is related to a bifurcation of steady-state solutions. In particular, transitions between diffuse and spot modes on axially symmetric cathodes, frequently observed in the experiment, represent an indication of the presence of pitchfork or fold bifurcations of steady-state solutions. Experimental observations of transitions on cathodes of DC glow microdischarges are analyzed and those potentially related to bifurcations of steady-state solutions are identified. The relevant bifurcations are investigated numerically and the computed patterns are found to conform to those observed in the course of the corresponding transitions in the experiment.
Hoi, Bui Dinh; Davoudiniya, Masoumeh; Yarmohammadi, Mohsen
2018-04-01
Based on theoretically tight-binding calculations considering nearest neighbors and Green's function technique, we show that the magnetic phase transition in both semiconducting and metallic armchair graphene nanoribbons with width ranging from 9.83 Å to 69.3 Å would be observed in the presence of injecting electrons by doping. This transition is explained by the temperature-dependent static charge susceptibility through calculation of the correlation function of charge density operators. This work showed that charge concentration of dopants in such system plays a crucial role in determining the magnetic phase. A variety of multicritical points such as transition temperatures and maximum susceptibility are compared in undoped and doped cases. Our findings show that there exist two different transition temperatures and maximum susceptibility depending on the ribbon width in doped structures. Another remarkable point refers to the invalidity (validity) of the Fermi liquid theory in nanoribbons-based systems at weak (strong) concentration of dopants. The obtained interesting results of magnetic phase transition in such system create a new potential for magnetic graphene nanoribbon-based devices.
Energy Technology Data Exchange (ETDEWEB)
Ertas, Mehmet [Department of Physics, Erciyes University, 38039 Kayseri (Turkey); Institute of Science, Erciyes University, 38039 Kayseri (Turkey); Deviren, Bayram [Department of Physics, Nevsehir University, 50300 Nevsehir (Turkey); Keskin, Mustafa, E-mail: keskin@erciyes.edu.tr [Department of Physics, Erciyes University, 38039 Kayseri (Turkey)
2012-03-15
The dynamic phase transitions are studied in the kinetic spin-2 Blume-Capel model under a time-dependent oscillating magnetic field using the effective-field theory with correlations. The effective-field dynamic equation for the average magnetization is derived by employing the Glauber transition rates and the phases in the system are obtained by solving this dynamic equation. The nature (first- or second-order) of the dynamic phase transition is characterized by investigating the thermal behavior of the dynamic magnetization and the dynamic phase transition temperatures are obtained. The dynamic phase diagrams are constructed in the reduced temperature and magnetic field amplitude plane and are of seven fundamental types. Phase diagrams contain the paramagnetic (P), ferromagnetic-2 (F{sub 2}) and three coexistence or mixed phase regions, namely the F{sub 2}+P, F{sub 1}+P and F{sub 2}+F{sub 1}+P, which strongly depend on the crystal-field interaction (D) parameter. The system also exhibits the dynamic tricritical behavior. - Highlights: Black-Right-Pointing-Pointer Dynamic phase transitions are studied in spin-2 BC model using EFT. Black-Right-Pointing-Pointer Dynamic phase diagrams are constructed in (T/zJ, h/zJ) plane. Black-Right-Pointing-Pointer Seven fundamental types of dynamic phase diagrams are found in the system. Black-Right-Pointing-Pointer System exhibits dynamic tricritical behavior.
Two-order parameters theory of the metal-insulator phase transition kinetics in the magnetic field
Dubovskii, L. B.
2018-05-01
The metal-insulator phase transition is considered within the framework of the Ginzburg-Landau approach for the phase transition described with two coupled order parameters. One of the order parameters is the mass density which variation is responsible for the origin of nonzero overlapping of the two different electron bands and the appearance of free electron carriers. This transition is assumed to be a first-order phase one. The free electron carriers are described with the vector-function representing the second-order parameter responsible for the continuous phase transition. This order parameter determines mostly the physical properties of the metal-insulator transition and leads to a singularity of the surface tension at the metal-insulator interface. The magnetic field is involved into the consideration of the system. The magnetic field leads to new singularities of the surface tension at the metal-insulator interface and results in a drastic variation of the phase transition kinetics. A strong singularity in the surface tension results from the Landau diamagnetism and determines anomalous features of the metal-insulator transition kinetics.
Ramsay, Pam; Huby, Guro; Thompson, Andrew; Walsh, Tim
2014-03-01
To explore the psychosocial needs of patients discharged from intensive care, the extent to which they are captured using existing theory on transitions in care and the potential role development of critical care outreach, follow-up and liaison services. Intensive care patients are at an increased risk of adverse events, deterioration or death following ward transfer. Nurse-led critical care outreach, follow-up or liaison services have been adopted internationally to prevent these potentially avoidable sequelae. The need to provide patients with psychosocial support during the transition to ward-based care has also been identified, but the evidence base for role development is currently limited. Twenty participants were invited to discuss their experiences of ward-based care as part of a broader study on recovery following prolonged critical illness. Psychosocial distress was a prominent feature of their accounts, prompting secondary data analysis using Meleis et al.'s mid-range theory on experiencing transitions. Participants described a sense of disconnection in relation to profound debilitation and dependency and were often distressed by a perceived lack of understanding, indifference or insensitivity among ward staff to their basic care needs. Negotiating the transition between dependence and independence was identified as a significant source of distress following ward transfer. Participants varied in the extent to which they were able to express their needs and negotiate recovery within professionally mediated boundaries. These data provide new insights into the putative origins of the psychosocial distress that patients experience following ward transfer. Meleis et al.'s work has resonance in terms of explicating intensive care patients' experiences of psychosocial distress throughout the transition to general ward-based care, such that the future role development of critical care outreach, follow-up and liaison services may be more theoretically informed
Serbian demographers on demography
Directory of Open Access Journals (Sweden)
Rašević Mirjana
2013-01-01
Full Text Available Introduction: The objective of this paper is to collect the opinions of the leading demographers in Serbia on four significant matters. The matters are: development, state and future of demography, the successfulness of researchers in this scientific discipline, improvement of the Stanovništvo journal, as well as the population priority of our society and range of population policies. Method: A qualitative interview was chosen as the instrument for data collection. Namely, a structured interview, based on nine questions was sent by e-mail to eleven addresses of relevant demographers in the second half of October 2013. The basic reason for sending questions by e-mail was the aspiration to obtain authentic replies which require time for contemplation. Ten completed questionnaires were returned within two weeks. On the one hand, an integral picture on the chosen themes for research was attempted to be obtained in the analysis of received opinions to certain groups of questions and on the other hand to portray the spectrum of different observations. The responses of our prominent demographers were analyzed and compared to clearly pronounced standpoints of eminent demographers published in world journals on similar themes and with findings of internet researches among members of the International Union for the Scientific Study of Population. Results: The results show that there is a high level of consent among demographers in Serbia regarding the well positioning of demography in relation to other social studies and its good perspectives. The interviewed experts see the future of demography in its integration with a wide circle of sciences, the application of demography and/or greater engagement of researchers in carrying out public policies. However, the estimations of the interviewed demographers as regards the development and state of demography in Serbia are divided. Although a large number of topics had been listed, migrations and population
Shchekin, Alexander K; Shabaev, Ilya V; Hellmuth, Olaf
2013-02-07
Thermodynamic and kinetic peculiarities of nucleation, deliquescence and efflorescence transitions in the ensemble of droplets formed on soluble condensation nuclei from a solvent vapor have been considered. The interplay of the effects of solubility and the size of condensation nuclei has been analyzed. Activation barriers for the deliquescence and phase transitions and for the reverse efflorescence transition have been determined as functions of the relative humidity of the vapor-gas atmosphere, initial size, and solubility of condensation nuclei. It has been demonstrated that, upon variations in the relative humidity of the atmosphere, the crossover in thermodynamically stable and unstable variables of the droplet state takes place. The physical meaning of stable and unstable variables has been clarified. The kinetic equations for establishing equilibrium and steady distributions of binary droplets have been solved. The specific times for relaxation, deliquescence and efflorescence transitions have been calculated.
Demographic Change and Transport
DEFF Research Database (Denmark)
Haustein, Sonja; Siren, Anu Kristiina; Framke, Elisabeth
This report is the literature review on demographic changes and transport of Work Package 1 of the EU project CONSOL, “CONcerns and SOLutions – Road Safety in the Ageing Societies” (contract period: 2011-2013). The report is a state-of-the art report that combines current knowledge with new...
Country Demographic Profiles: Thailand.
Bureau of the Census (DOC), Suitland, MD. Population Div.
This profile of the population of Thailand contains 35 tables of selected demographic information, including size of population and estimates of fertility and mortality, beginning in 1950. An adjusted distribution of the population by age and sex is given for the latest census year, as well as for 1976. Projections of the number of women of…
Jiayan LIU
2017-01-01
Along with a full-scale transition in both the urban development pattern and the socio-economic development in China, the planning of urban residential pace has experienced a significant transition process from the residential area planning in traditional Danwei system, to the commercial housing estate planning in marketized housing system, then to the springing up of contemporary community planning. On the basis of an analysis of the primary goal, form, and limitations of community planning ...
Halalay, Ion C.
A study of the structural glass transition trough impulsive stimulated light scattering experiments has been carried out in concentrated aqueous lithium chloride solutions, at temperatures ranging from ambient to cryogenic. A specially designed sample cell made it possible to cover the whole temperature interval from simple liquid, to viscoelastic supercooled liquid, to glass. It is shown that a phenomenological description of the results of these experiments in terms of a spectrum of relaxation times through the use of a Kohlrausch-Williams-Watts relaxation function is inadequate. Based on predictions of mode-coupling theory of the liquid-glass transition, an alternative approach to data interpretation is proposed. It is shown that for an aqueous lithium chloride solution, the prediction of simple scaling and identical scaling for mechanical and electrical susceptibilities seems to be valid. However, another prediction of theory is called into question: instead of a power-law behavior on temperature difference, it is found experimentally that the behavior of the susceptibility spectrum minimum is exponential. Similar disagreements are found for other two materials, triphenyl phosphite and polypropylene oxide. The causes for these discrepancies are discussed and it is concluded that additional experimentation is necessary to verify theoretical claims. Experiments are proposed which can test these predictions and serve as guide for the construction of theoretical models for the glass transition in real systems. (Copies available exclusively from MIT Libraries, Rm. 14-0551, Cambridge, MA 02139-4307. Ph. 617 -253-5668; Fax 617-253-1690.).
Directory of Open Access Journals (Sweden)
Franz Breuer
2011-03-01
Full Text Available This article outlines the development of a theory of predecessor-successor transitions in social contexts using a grounded theory approach. The theory can be applied to such diverse phenomena as the transfer of family businesses to the next generation, university chair succession, the passing on of parental roles (for example in the case of adoption or remarriage, and organ transplantation. The core conceptual category that emerged was "the transfer of personal objects". This concept refers to the transfer of the power of disposal over objects that are fundamental to the identity and the identification of the owner. A number of theoretical dimensions of the category were identified. Methodologically speaking, the theory generated can be classified as a formal grounded theory. In other words, the comparison of different empirical fields and cases using hermeneutical analysis yielded a transdisciplinary social science category that can be employed to conceptualise the dynamics of the development of interpersonal, social, or institutional structures, especially with regard to the links and the interplay between material and symbolic components, between the individual and the social, and the past and the present. URN: http://nbn-resolving.de/urn:nbn:de:0114-fqs1102165
Zheng, Xiu-Deng; Tao, Yi
2017-03-01
The evolutionary significance of the interaction between paternal and maternal genomes in fertilized zygotes is a very interesting and challenging question. Wang et al. developed the concept of epigenetic game theory, and they try to use this concept to explain the interaction between paternal and maternal genomes in fertilized zygotes [1]. They emphasize that the embryogenesis can be considered as an ecological system in which two highly distinct and specialized gametes coordinate through either cooperation or competition, or both, to maximize the fitness of embryos under Darwinian selection. More specifically, they integrate game theory to model the pattern of coordination of paternal genome and maternal genomes mediated by DNA methylation dynamics, and they called this epigenetic game theory.
Goodwin, Miki; Candela, Lori
2013-06-01
The aim of this qualitative study was to explore if newly practicing nurses benefited from learning holistic comfort theory during their baccalaureate education, and to provide a conceptual framework to support the transition from school to practice. The study was conducted among graduates of an accelerated baccalaureate nursing program where holistic comfort theory was embedded as a learner-centered philosophy across the curriculum. A phenomenological process using van Manen's qualitative methodology in education involving semi-structured interviews and thematic analysis was used. The nurses recalled what holistic comfort meant to them in school, and described the lived experience of assimilating holistic comfort into their attitudes and behaviors in practice. Themes were established and a conceptual framework was developed to better understand the nurses' lived experiences. Results showed that holistic comfort was experienced as a constructive approach to transcend unavoidable difficulties during the transition from school to practice. Participants described meaningful learning and acquisition of self-strengthening behaviors using holistic comfort theory. Holistic comfort principles were credited for easing nurses into the realities of work and advocating for best patient outcomes. Patient safety and pride in patient care were incidental positive outcomes. The study offers new insights about applying holistic comfort to prepare nurses for the realities of practice. Copyright © 2012 Elsevier Ltd. All rights reserved.
Zhang, Yu; Mukamel, Shaul; Khalil, Munira; Govind, Niranjan
2015-12-08
Valence-to-core (VtC) X-ray emission spectroscopy (XES) has emerged as a powerful technique for the structural characterization of complex organometallic compounds in realistic environments. Since the spectrum represents electronic transitions from the ligand molecular orbitals to the core holes of the metal centers, the approach is more chemically sensitive to the metal-ligand bonding character compared with conventional X-ray absorption techniques. In this paper we study how linear-response time-dependent density functional theory (LR-TDDFT) can be harnessed to simulate K-edge VtC X-ray emission spectra reliably. LR-TDDFT allows one to go beyond the single-particle picture that has been extensively used to simulate VtC-XES. We consider seven low- and high-spin model complexes involving chromium, manganese, and iron transition metal centers. Our results are in good agreement with experiment.
Hsu, Fei-Man; Chen, Pao-Yang
2017-03-01
Von Neumann and Morgenstern published the Theory of Games and Economic Behavior in 1944, describing game theory as a model in which intelligent rational decision-makers manage to find their best strategies in conflict, cooperative or other mutualistic relationships to acquire the greatest benefit [1]. This model was subsequently incorporated in ecology to simulate the ;fitness; of a species during natural selection, designated evolutionary game theory (EGT) [2]. Wang et al. proposed ;epiGame;, taking paternal and maternal genomes as ;intelligent; players that compete, cooperate or both during embryogenesis to maximize the fitness of the embryo [3]. They further extended game theory to an individual or single cell environment. During early zygote development, DNA methylation is reprogrammed such that the paternal genome is demethylated before the maternal genome. After the reset, the blastocyst is re-methylated during embryogenesis. At that time, the paternal and maternal genomes have a conflict of interest related to the expression of their own genes. The proposed epiGame models such interactive regulation between the parental genomes to reach a balance for embryo development (equation (2)).
EJSCREEN Demographic Indicators 2015 Public
EJSCREEN uses demographic factors as very general indicators of a community's potential susceptibility to the types of environmental factors included in this screening tool. There are six demographic indicators: Demographic Index, Supplementary Demographic Index, Individuals under Age 5, Individuals over Age 64, Percent Low-Income, Linguistic Isolation, Percent Minority, and Less than High School Education.
1983-01-01
A review of demographic trends in Luxembourg in 1982 is presented. A decline in fertility, the first since 1977, is noted, together with an increase in divorce, as well as a negative migration balance for the first time since 1967. Topics covered include natural increase and migration, fertility, marriage and divorce, mortality, adoption, and legislation affecting the family. Special consideration is given to the mortality experience of those who were subjected to compulsory labor during World War II.
Demographics, political power and economic growth.
Holtz-eakin, D
1993-01-01
"Growth theory may be used to predict the response of saving, capital formation, and output growth to large demographic shifts. Such large shifts would also be expected to alter the demand for government services and the desired levels of taxation in the population. This paper extends the overlapping-generations model of economic growth to predict the evolution of government tax and spending policy through the course of a major demographic shift. Simulations suggest that this approach may yield valuable insights into the evolution of policy in the United States and other industrialized economies." excerpt
Energy Technology Data Exchange (ETDEWEB)
Jungsuttiwong, Siriporn, E-mail: siriporn.j@ubu.ac.th [Department of Chemistry and Center of Excellence for Innovation in Chemistry, Faculty of Science, Ubon Ratchathani University, Ubon Ratchathani 34190 (Thailand); Wongnongwa, Yutthana [Department of Chemistry and Center of Excellence for Innovation in Chemistry, Faculty of Science, Ubon Ratchathani University, Ubon Ratchathani 34190 (Thailand); Namuangruk, Supawadee [National Nanotechnology Center (NANOTEC), National Science and Technology Development Agency (NSTDA), Klong Luang, Pathum Thani 12120 (Thailand); Kungwan, Nawee [Department of Chemistry, Faculty of Science, Chiang Mai University, Chiang Mai 50200 (Thailand); Promarak, Vinich [Department of Material Science and Engineering, School of Molecular Science and Engineering, Vidyasirimedhi Institute of Science and Technology, Rayong 21210 (Thailand); Kunaseth, Manaschai, E-mail: manaschai@nanotec.or.th [National Nanotechnology Center (NANOTEC), National Science and Technology Development Agency (NSTDA), Klong Luang, Pathum Thani 12120 (Thailand)
2016-01-30
Graphical abstract: Decoration of Pd{sub 4}-A (square planar) on B-doped graphene significantly promotes Hg{sup 0} adsorption, a single site of Pd{sub 4} cluster on BDG could strongly adsorb up to six Hg atoms. - Highlights: • Transition metal atom and cluster binds strongly on B-doped graphene surface. • Decoration of transition metal on B-doped graphene significantly promotes Hg{sup 0} adsorption. • Adsorption strength of Hg{sup 0} atom on metal decorated B-doped graphene: Pd > Pt > Ru > W > Cu. • One site decorated Pd4 cluster adsorbed Hg{sup 0} strongly up to six atoms.
University Utrecht
1992-01-01
A simple density functional theory for the various liquid-crystalline phases of parallel hard spherocylinders is formulated on the basis of Pynn's ansatz for the direct correlation function of the spherocylinders. Fair agreement with the computer simulations is found.
International Nuclear Information System (INIS)
Falicov, L.M.; Somorjai, G.A.
1985-01-01
Correlation between catalytic activity and low-energy local electronic fluctuation in transition metals is proposed. A theory and calculations are presented which indicate that maximum electronic fluctuants take place at high-coordination metal sites. Either (i) atomically rough surfaces that expose to the reactant molecules atoms with large numbers of nonmagnetic or weakly magnetic neighbors in the first or second layer at the surface or (ii) stepped and kinked surfaces are the most active in carrying out structure-sensitive catalytic reactions. The synthesis of ammonia from N 2 and H 2 over iron and rhenium surfaces, 1 H 2 / 2 H 2 exchange over stepped platinum crystal surfaces at low pressures, and the hydrogenolysis (C - C bond breaking) of isobutane at kinked platinum crystal surfaces are presented as experimental evidence in support of the theory
A Statistical Assessment of Demographic Bonus towards Poverty Alleviation
Directory of Open Access Journals (Sweden)
Jamal Abdul Nasir
2011-09-01
Full Text Available The shift of birth and death rates from high to low level in any population is referred as demographic transition. Mechanically, the transition of a society creates more working member of its own population commonly called demographic bonus. This articleempirically explores the realistic soundness of demographic bonus in reducing the poverty level of the society. Three contrasting regions namely Eastern Asia, Central America and Oceania were selected for analytical purposes. The findings indicate that Eastern Asia and Oceania are currently facing the end of their transition whereas theCentral America is lagged behind in transition. Central America due to last runner in transition race is the sustained recipient of its own demographic bonus by the year 2030.On the basis of three mechanisms namely: labour supply, savings and human capital, the Eastern Asian region is found to be successful beneficiary of its own demographic gift which concludes that many million people have escaped from poverty. Under the right policy environment on the above three mechanisms, Eastern Asia experience indicates the realistic contribution of demographic bonus to reduce poverty.
State and transition models (STMs) are used for communicating about ecosystem change in rangelands and other ecosystems, especially the implications for management. The fundamental premise that rangelands can exhibit multiple states is now widely accepted. The current application of STMs for managem...
Topological phase transitions of (BixSb1-x)2Se3 alloys by density functional theory.
Abdalla, L B; Padilha José, E; Schmidt, T M; Miwa, R H; Fazzio, A
2015-07-01
We have performed an ab initio total energy investigation of the topological phase transition, and the electronic properties of topologically protected surface states of (BixSb1-x)2Se3 alloys. In order to provide an accurate alloy concentration for the phase transition, we have considered the special quasirandom structures to describe the alloy system. The trivial → topological transition concentration was obtained by (i) the calculation of the band gap closing as a function of Bi concentration (x), and (ii) the calculation of the Z2 topological invariant number. We show that there is a topological phase transition, for x around 0.4, verified for both procedures (i) and (ii). We also show that in the concentration range 0.4 x < 0.7, the alloy does not present any other band at the Fermi level besides the Dirac cone, where the Dirac point is far from the bulk states. This indicates that a possible suppression of the scattering process due to bulk states will occur.
Hüfner, J.; Klevansky, S. P.; Rehberg, P.
1996-02-01
Critical phenomena associated with Mott transitions are investigated in the finite temperature SUf(3) Nambu-Jona-Lasinio model, that describes quarks u, d, s and bound mesons π, K. Critical exponents for the behavior close to the Mott temperature TM are determined for the static properties of a pion, such as mπ( T), gπqq( T), fπ( T), π, and the pion polarizabilities αC, N, as well as for the behavior of mK( T), gKqs( T) fK( T) in the strange sector. The effect of the Mott transitions on the q overlineq and ππ scattering lengths and for hadronization cross sections σ q overlineq→ππ (T) is discussed. Divergencies that occur in these quantities at TM indicate an intransparence with respect to hadronic and photonic probes, much like the phenomenon of critical opalescence. Physically, the Mott transition models the deconfinement transition expected of QCD since it corresponds to a delocalizayion of the bound states when the temperature is raised above TM.
International Nuclear Information System (INIS)
Tchangnwa Nya, F; Ayadim, A; Germain, Ph; Amokrane, S
2012-01-01
We examine the question of the accuracy of the static correlation functions used as input in the mode coupling theory (MCT) of non-ergodic states in binary mixtures. We first consider hard-sphere mixtures and compute the static pair structure from the Ornstein-Zernike equations with the Percus-Yevick closure and more accurate ones that use bridge functions deduced from Rosenfeld’s fundamental measures functional. The corresponding MCT predictions for the non-ergodicity lines and the transitions between multiple glassy states are determined from the long-time limit of the density autocorrelation functions. We find that while the non-ergodicity transition line is not very sensitive to the input static structure, up to diameter ratios D 2 /D 1 = 10, quantitative differences exist for the transitions between different glasses. The discrepancies with the more accurate closures become even qualitative for sufficiently asymmetric mixtures. They are correlated with the incorrect behavior of the PY structure at high size asymmetry. From the example of ultra-soft potential it is argued that this issue is of general relevance beyond the hard-sphere model. (paper)
Tournier, Robert F.
2018-01-01
Glass-to-glass and liquid-to-liquid phase transitions are observed in bulk and confined water, with or without applied pressure. They result from the competition of two liquid phases separated by an enthalpy difference depending on temperature. The classical nucleation equation of these phases is completed by this quantity existing at all temperatures, a pressure contribution, and an enthalpy excess. This equation leads to two homogeneous nucleation temperatures in each liquid phase; the first one (Tn- below Tm) being the formation temperature of an "ordered" liquid phase and the second one corresponding to the overheating temperature (Tn+ above Tm). Thermodynamic properties, double glass transition temperatures, sharp enthalpy and volume changes are predicted in agreement with experimental results. The first-order transition line at TLL = 0.833 × Tm between fragile and strong liquids joins two critical points. Glass phase above Tg becomes "ordered" liquid phase disappearing at TLL at low pressure and at Tn+ = 1.302 × Tm at high pressure.
Zhang, Hui; Zhang, Xin; Truhlar, Donald G; Xu, Xuefei
2017-11-30
The reaction between H and benzene is a prototype for reactions of radicals with aromatic hydrocarbons. Here we report calculations of the reaction rate constants and the branching ratios of the two channels of the reaction (H addition and H abstraction) over a wide temperature and pressure range. Our calculations, obtained with an accurate potential energy surface, are based on variational transition-state theory for the high-pressure limit of the addition reaction and for the abstraction reaction and on system-specific quantum Rice-Ramsperger-Kassel theory calibrated by variational transition-state theory for pressure effects on the addition reaction. The latter is a very convenient way to include variational effects, corner-cutting tunneling, and anharmonicity in falloff calculations. Our results are in very good agreement with the limited experimental data and show the importance of including pressure effects in the temperature interval where the mechanism changes from addition to abstraction. We found a negative temperature effect of the total reaction rate constants at 1 atm pressure in the temperature region where experimental data are missing and accurate theoretical data were previously missing as well. We also calculated the H + C 6 H 6 /C 6 D 6 and D + C 6 H 6 /C 6 D 6 kinetic isotope effects, and we compared our H + C 6 H 6 results to previous theoretical data for H + toluene. We report a very novel nonmonotonic dependence of the kinetic isotope effect on temperature. A particularly striking effect is the prediction of a negative temperature dependence of the total rate constant over 300-500 K wide temperature ranges, depending on the pressure but generally in the range from 600 to 1700 K, which includes the temperature range of ignition in gasoline engines, which is important because aromatics are important components of common fuels.
EJSCREEN Version 1, Demographic Data
U.S. Environmental Protection Agency — This map service displays demographic data used in EJSCREEN. All demographic data were derived from American Community Survey 2006-2010 estimates. EJSCREEN is an...
Energy Technology Data Exchange (ETDEWEB)
Balzer, Matthias
2008-07-01
The central goal of this thesis is the examination of strongly correlated electron systems on the basis of the two-dimensional Hubbard model. We analyze how the properties of the Mott insulator change upon doping and with interaction strength. The numerical evaluation is done using quantum cluster approximations, which allow for a thermodynamically consistent description of the ground state properties. The framework of self-energy-functional theory offers great flexibility for the construction of cluster approximations. A detailed analysis sheds light on the quality and the convergence properties of different cluster approximations within the self-energy-functional theory. We use the one-dimensional Hubbard model for these examinations and compare our results with the exact solution. In two dimensions the ground state of the particle-hole symmetric model at half-filling is an antiferromagnetic insulator, independent of the interaction strength. The inclusion of short-range spatial correlations by our cluster approach leads to a considerable improvement of the antiferromagnetic order parameter as compared to dynamical mean-field theory. In the paramagnetic phase we furthermore observe a metal-insulator transition as a function of the interaction strength, which qualitatively differs from the pure mean-field scenario. Starting from the antiferromagnetic Mott insulator a filling-controlled metal-insulator transition in a paramagnetic metallic phase can be observed. Depending on the cluster approximation used an antiferromagnetic metallic phase may occur at first. In addition to long-range antiferromagnetic order, we also considered superconductivity in our calculations. The superconducting order parameter as a function of doping is in good agreement with other numerical methods, as well as with experimental results. (orig.)
Directory of Open Access Journals (Sweden)
Eugeniy A. Lukashev
2017-11-01
Full Text Available The occurrence of convective currents and their development from regular forms with the subsequent transition to irregular turbulent currents draw attention to the fact that they are responsible for the efficiency of many technological processes of heat and mass transfer. Such technological processes are basic in the chemical, petrochemical, power, metallurgical and other industries. Convective flows arise in liquids and gases in the gravitational field in the presence of spatial inhomogeneity of the density created by the inhomogeneity of the temperature and the concentration of components arising during, for example, chemical reactions or other causes. With increasing temperature difference, the resting liquid loses its stability, which then leads to the appearance of a convective flow (Rayleigh–Bénard instability. A further increase in the temperature difference leads to an instability of the primary convective flow, and the hydrodynamic crisis leads to a heat transfer crisis. The paper reconstructs the early stage of the Rayleigh–Bénard convective instability considered as a nonequilibrium phase transition with the spinodal decomposition (diffusion separation mechanism.
Energy Technology Data Exchange (ETDEWEB)
Xu, Xuewen, E-mail: xuxuewen@hebut.edu.cn [School of Materials Science and Engineering, Hebei University of Technology, Tianjin 300130 (China); Fu, Kun [School of Computer Science and Engineering, Hebei University of Technology, Tianjin 300130 (China); Li, Lanlan; Lu, Zunming; Zhang, Xinghua; Fan, Ying; Lin, Jing; Liu, Guodong; Luo, Hongzhi; Tang, Chengchun [School of Materials Science and Engineering, Hebei University of Technology, Tianjin 300130 (China)
2013-06-15
We systematically investigated the crystal structure, stability, elastic properties, chemical bonding and electronic properties of the early-transition-metal monoborides (TMBs, where TM=Sc, Ti, V, Cr, Y, Zr, Nb, Mo, Hf, Mo, and W) using the ab initio calculations based on the density functional theory. The results indicated that all 11 TMBs crystallized to a CrB-type structure are thermodynamically and mechanically stable. The elastic constants were calculated using the finite strain method. The correlation between the electronic structure and elastic properties was discussed. YB was found to have high machinability (B/C{sub 44}=1.73) and low hardness (C{sub 44}=43 GPa). The weak interaction between the interleaved yttrium planes and weak pd bonding resulted in the good machinability of YB.
Directory of Open Access Journals (Sweden)
S. W. Y. Tam
Full Text Available Recent in situ observations have revealed novel features in the polar wind. Measurements between 5000 and 9000 km altitude by the Akebono satellite indicate that both H^{+} and O^{+} ions can have remarkably higher outflow velocities in the sunlit region than on the nightside. Electrons also display an asymmetric behavior: the dayside difference in energy spread, greater for upward-moving than downward-moving electrons, is absent on the nightside. Here, we discuss the further development of a theory by Tam et al. that can explain most of these observed peculiar properties by properly taking into account the global, kinetic, collisional effects of the sunlit photoelectrons, on the background polar wind and the electric field. Quantitative comparisons of the calculated results with actual data will be described. In addition, transition from the daytime photoelectron-driven polar wind to the night-time polar wind will be discussed.
Wichers, Marieke; Schreuder, Marieke; Hartman, Catharina; Wigman, Hanneke
2018-01-01
Abstract Background Recently, we showed that assumptions from complex system theory seem applicable in the field of psychiatry. This means that indicators of critical slowing down in the system signal the risk for a critical transition in the near future. In the current study we wanted to explore whether the principle of critical slowing down may also be informative to anticipate on the type of symptoms that individuals are most likely to develop. This is relevant as it may lead to personalized prediction of risk of whether adolescents with mixed complaints are most likely to develop either depression, anxiety, somatic or psychotic symptoms in the near future. For example, we hypothesized that critical slowing down in feeling ‘suspicious’ more strongly indicates risk for a future transition to psychotic symptoms, while critical slowing down in feeling ‘down’ more strongly indicates risk for a transition to depressive symptoms. Methods We examined this in a population of adolescents (most between 15 and 18 years) as adolescents are an at-risk group for the development of psychopathology. At baseline experience sampling was performed for 6 days, 10 measurements a day. Affect items were used to assess autocorrelation as an indicator of ‘critical slowing down’ of the system. At baseline and follow-up SCL-90 questionnaires were administered. In total, 147 adolescents participated both in baseline and follow-up measures and showed increases in at least one of the defined symptom dimensions. We examined whether autocorrelation was positively associated with the size of symptom transition and whether different type of transitions (in depression, anxiety etc.) were differentially predicted by autocorrelations in specific affect states. Results The analyses were done very recently, and findings have not been presented before. We found both shared and specific indicators of risk in the development for transition to various symptom dimensions. First
Vereecken, Luc; Peeters, Jozef
2003-09-01
The rigorous implementation of transition state theory (TST) for a reaction system with multiple reactant rotamers and multiple transition state conformers is discussed by way of a statistical rate analysis of the 1,5-H-shift in 1-butoxy radicals, a prototype reaction for the important class of H-shift reactions in atmospheric chemistry. Several approaches for deriving a multirotamer TST expression are treated: oscillator versus (hindered) internal rotor models; distinguishable versus indistinguishable atoms; and direct count methods versus degeneracy factors calculated by (simplified) direct count methods or from symmetry numbers and number of enantiomers, where applicable. It is shown that the various treatments are fully consistent, even if the TST expressions themselves appear different. The 1-butoxy H-shift reaction is characterized quantum chemically using B3LYP-DFT; the performance of this level of theory is compared to other methods. Rigorous application of the multirotamer TST methodology in an harmonic oscillator approximation based on this data yields a rate coefficient of k(298 K,1 atm)=1.4×105 s-1, and an Arrhenius expression k(T,1 atm)=1.43×1011 exp(-8.17 kcal mol-1/RT) s-1, which both closely match the experimental recommendations in the literature. The T-dependence is substantially influenced by the multirotamer treatment, as well as by the tunneling and fall-off corrections. The present results are compared to those of simplified TST calculations based solely on the properties of the lowest energy 1-butoxy rotamer.
Complexity and demographic explanations of cumulative culture.
Querbes, Adrien; Vaesen, Krist; Houkes, Wybo
2014-01-01
Formal models have linked prehistoric and historical instances of technological change (e.g., the Upper Paleolithic transition, cultural loss in Holocene Tasmania, scientific progress since the late nineteenth century) to demographic change. According to these models, cumulation of technological complexity is inhibited by decreasing--while favoured by increasing--population levels. Here we show that these findings are contingent on how complexity is defined: demography plays a much more limited role in sustaining cumulative culture in case formal models deploy Herbert Simon's definition of complexity rather than the particular definitions of complexity hitherto assumed. Given that currently available empirical evidence doesn't afford discriminating proper from improper definitions of complexity, our robustness analyses put into question the force of recent demographic explanations of particular episodes of cultural change.
Complexity and demographic explanations of cumulative culture.
Directory of Open Access Journals (Sweden)
Adrien Querbes
Full Text Available Formal models have linked prehistoric and historical instances of technological change (e.g., the Upper Paleolithic transition, cultural loss in Holocene Tasmania, scientific progress since the late nineteenth century to demographic change. According to these models, cumulation of technological complexity is inhibited by decreasing--while favoured by increasing--population levels. Here we show that these findings are contingent on how complexity is defined: demography plays a much more limited role in sustaining cumulative culture in case formal models deploy Herbert Simon's definition of complexity rather than the particular definitions of complexity hitherto assumed. Given that currently available empirical evidence doesn't afford discriminating proper from improper definitions of complexity, our robustness analyses put into question the force of recent demographic explanations of particular episodes of cultural change.
On the theory of global population growth
International Nuclear Information System (INIS)
Kapitza, Sergei P
2010-01-01
Ours is an epoch of global demographic revolution, a time of a rapid transition from explosive population growth to a low reproduction level. This, possibly the most momentous change ever witnessed by humankind has, first and foremost, important implications for the dynamics of population. But it also affects billions of people in all aspects of their lives, and it is for this reason that demographic processes have grown into a vast problem, both globally and in Russia. Their fundamental understanding will to a large extent impact the present, the short-term future following the current critical epoch, the stable and uniform global development and its priorities, and indeed global security. Quantitative treatment of historical processes is reached using the phenomenological theory of mankind's population growth. This theory relies on the concepts and methods of physics and its conclusions should take into account the ideas of economics and genetics. (interdisciplinary physics)
Demographic Evolution in Romania – Convergence or Peripherisation?
Directory of Open Access Journals (Sweden)
Adriana Veronica Litra
2006-02-01
Full Text Available Romania began its demographic transition about one century later than the developed countries. We put the blame of this gap on the delayed economic, social and political development in comparison with the Western Europe. But also, it could not be forgotten the shift from a population forced and subdue by the totalitary regime, to a free people to decide when to have a child or how large should be the family. During transition, Romania has pointed many negative demographic evolutions, as compared with the other european countries. It may be said that the transition in Romania over the period 1990-2004 adjusted the classical pattern of demographic evolution. Not fully felt at this moment, we will probably find ourselves few decades later older, less, deprived of skilled labor force and unbalanced as gender ratio.
Energy Technology Data Exchange (ETDEWEB)
Liu, Qi-Jun, E-mail: qijunliu@home.swjtu.edu.cn [Bond and Band Engineering Group, Sichuan Provincial Key Laboratory (for Universities) of High Pressure Science and Technology, School of Physical Science and Technology, Southwest Jiaotong University, Chengdu, Sichuan 610031 (China); Zhang, Ning-Chao; Sun, Yan-Yun; Zhang, Ming-Jian; Liu, Fu-Sheng [Bond and Band Engineering Group, Sichuan Provincial Key Laboratory (for Universities) of High Pressure Science and Technology, School of Physical Science and Technology, Southwest Jiaotong University, Chengdu, Sichuan 610031 (China); Liu, Zheng-Tang [State Key Laboratory of Solidification Processing, School of Materials Science and Engineering, Northwestern Polytechnical University, Xi' an, Shaanxi 710072 (China)
2014-03-01
Using first-principles density-functional theory, we have investigated the pressure-induced phase transition in hydronitrogen compound N{sub 4}H{sub 4} and discussed the potential tetragonal structure. We find that tetragonal structure with P4{sub 2}/n space group is mechanically stable and ductile. The thermodynamic stability of Pmna>P1{sup ¯}>P4{sub 2}/n>P2{sub 1}/m has been obtained. With increasing pressure, the phase transition pressures of T{sub Pmna→P4{sub 2/n}}, T{sub P4{sub 2/n→Pmna}}, T{sub Pmna→P1{sup ¯}} and T{sub P1{sup ¯}→P2{sub 1/m}} are 5.6, 15.0, 30.0 and 69.2 GPa, respectively, which are in agreement with the available data. Moreover, the mechanical stability of four structures under pressure has been analyzed.
Li, Man; Wang, Yanhui; Jia, Limin
2017-01-01
Aimed at the complicated problems of attraction characteristics regarding passenger flow in urban rail transit network, the concept of the gravity field of passenger flow is proposed in this paper. We establish the computation methods of field strength and potential energy to reveal the potential attraction relationship among stations from the perspective of the collection and distribution of passenger flow and the topology of network. As for the computation methods of field strength, an optimum path concept is proposed to define betweenness centrality parameter. Regarding the computation of potential energy, Compound Simpson's Rule Formula is applied to get a solution to the function. Taking No. 10 Beijing Subway as a practical example, an analysis of simulation and verification is conducted, and the results shows in the following ways. Firstly, the bigger field strength value between two stations is, the stronger passenger flow attraction is, and the greater probability of the formation of the largest passenger flow of section is. Secondly, there is the greatest passenger flow volume and circulation capacity between two zones of high potential energy.
Energy Technology Data Exchange (ETDEWEB)
Merkulov, I A; Papava, Y I; Ponomarenko, V V [Leningradskij Gosudarstvennyj Univ., Leningrad (Russian Federation); Vasiliev, S I [Carleton Univ., Ottawa, ON (Canada). Dept. of Physics
1988-02-01
A phase transition of the nuclear spin system of a solid with dipolar and indirect scalar interactions is considered. Monte Carlo simulations of the spin-system isothermic states and of the adiabatic demagnetization process have been made. The structures and energies of the ground states and the values of the critical temperatures, T[sub C], and minimal polarizations, [rho][sub C], at which adiabatic demagnetization leads to spontaneous spin ordering, calculated for the GaAs and CaF[sub 2] nuclear spin systems, are presented. The results of numerical simulations are compared with the experimental data for CaF[sub 2]. The Weiss-field model is extended to the case of adiabatic demagnetization. The fluctuations of the local field are taken into account in the Gaussian approximation. It is shown that the proposed approach allows one to obtain asymptotically correct results both for T >> T[sub C] and T << T[sub C]. The results of the calculations in the Gaussian approximation are compared with the numerical simulations. (10 refs., 9 figs., tab.).
Directory of Open Access Journals (Sweden)
Man Li
Full Text Available Aimed at the complicated problems of attraction characteristics regarding passenger flow in urban rail transit network, the concept of the gravity field of passenger flow is proposed in this paper. We establish the computation methods of field strength and potential energy to reveal the potential attraction relationship among stations from the perspective of the collection and distribution of passenger flow and the topology of network. As for the computation methods of field strength, an optimum path concept is proposed to define betweenness centrality parameter. Regarding the computation of potential energy, Compound Simpson's Rule Formula is applied to get a solution to the function. Taking No. 10 Beijing Subway as a practical example, an analysis of simulation and verification is conducted, and the results shows in the following ways. Firstly, the bigger field strength value between two stations is, the stronger passenger flow attraction is, and the greater probability of the formation of the largest passenger flow of section is. Secondly, there is the greatest passenger flow volume and circulation capacity between two zones of high potential energy.
Directory of Open Access Journals (Sweden)
2009-02-01
Full Text Available In the period 1960-2000, male and female life expectancy increased by 8,2 and 10,5 years, respectively, in Catalonia, one of Spain's Autonomous Regions, to one of the highest in the world. Initially, most gains were due to lower infant mortality, but as cardiovascular diseases declined this later shifted to advanced ages. Between the mid-1980s and early 1990s life expectancy improvements stagnated as the mortality risk from traffic accidents and HIV/AIDS in young adults increased. Both the age-delay in old-age mortality and the simultaneous influence of behaviour and life style reflect distinct aspects of the fourth stage of the epidemiological transition. This analysis quantifies the age and cause of death contributions to changes and sex-differences in life expectancy in Catalonia. It subsequently compares the most recent life table for women with the Duchene-Wunsch limited life table to estimate the potential gain in life expectancy when all deaths would be ageing-related and on which ages these improvements would fall.
Demographics and remote locations
Energy Technology Data Exchange (ETDEWEB)
Coppus, G. [Dynawise Inc., Calgary, AB (Canada)
2005-07-01
Within the next decade, the number of people leaving the workforce will exceed the number of new entrants. The demand for workers is expected to increase in Alberta due to oil sands industry growth. Sixty-four per cent of all responding federal, provincial, and municipal government organizations have reported shortages in their work environments, and almost 8 in 10 organizations predict they will continue to be understaffed in the next 3 to 5 years. Tightness in the general labour market will have an impact on employers in remote locations, and planning is essential to avoid the creation of a mercenary culture and a reliance on compensation. Challenges found in remote locations include high turnover rates among recent hires; critical gaps in service length; aggressive retirement; and the fact that the local population is often seen as unqualified for many industrial jobs. This Power Point presentation suggested that although decisions to join or quit a company are often based on considerations such as the organizational environment and amount of compensation, the relationship between employees and management is the most important attribute in many career decisions. Rigorous quantitative analysis of current demographics combined with forecasting analysis may help to forestall recruitment difficulties for many companies. Productivity analyses, and the effects of work overload on absenteeism, attrition and quality of workmanship must also be examined. Many companies are now focusing on retention and development strategies on mid-career staff to address depletion, as well as redesigning procedures to operate with less skilled staff. It was concluded that extra efforts are now being made to attract non-traditional employees, and non-traditional employment models are being considered by some companies. refs., tabs., figs.
Intelligent system to study demographic evolution
Rodrigues, M. de Fatima; Ramos, Carlos; Henriques, Pedro R.
1999-02-01
With three centuries of existence, the study of population's behavior implies the manipulation of large amounts of incomplete and imprecise data with high dimensionality. By virtue of its multidisciplinary character, the work in demography involves at least historicists, statisticians and computer scientists/programmers. Moreover, successful demographic analysis requires qualified experts, who have succeeded in analysing data through many views and relate different sources of information, including their personal knowledge of the epoch or regions under study. In this paper, we present an intelligent system to study demographic evolution (ISSDE). This system has a module based on on-line analytical processing (OLAP), which permits conducting multiple analysis, combining many data dimensions. It has a deductive database system, which allows the execution of elaborated queries through the database. It has another module for date treatment (generalization and/or reduction); and, at last, a data mining module to discover nontrivial relations hidden within data. We discover the data treatment procedure with two phases: data generalization and data reduction. In data generalization, utilizing knowledge about concept hierarchies and relevance of data, aggregation of attribute values is performed. In the data reduction phase, rough set theory is applied to compute the minimal attribute set. We highlight the advantages of combining attribute value generalization with rough set theory, to find a subset of attributes that lets the mining process discover more useful patterns, by providing results from the application of the C5.0 algorithm in a demographic relational database.
Demographic structure and macroeconomic trends
Aksoy, Yunus; Basso, H.S.; Smith, Ronald; Grasl, Tobias
2018-01-01
We estimate the effect of changes in demographic structure on long term\\ud trends of key macroeconomic variables using a Panel VAR for 21 OECD economies from 1970-2014. The panel data variation assists the identification of demographic effects, while the dynamic structure,\\ud incorporating multiple channels of influence, uncovers long-term effects.\\ud We propose a theoretical model, relating demographics, innovation and\\ud growth, whose simulations match our empirical findings. The current\\ud...
Demographic Consequences of Defeating Aging
Gavrilov, Leonid A.; Gavrilova, Natalia S.
2010-01-01
A common objection against starting a large-scale biomedical war on aging is the fear of catastrophic population consequences (overpopulation). This fear is only exacerbated by the fact that no detailed demographic projections for radical life extension scenario have been conducted so far. This study explores different demographic scenarios and population projections, in order to clarify what could be the demographic consequences of a successful biomedical war on aging. A general conclusion o...
Igumbor, E.; Mapasha, R. E.; Meyer, W. E.
2018-04-01
Results based on density functional theory modelling of electronic and structural properties of single layer WTe2 dichalcogenides doped with X (X=H, Li and Be) were presented. The generalized gradient approximation functional of Perdew, Burke, and Ernzerhof exchange correlation was used for all calculations. Formation energies of X dopant substituted for W (XW) were obtained to be between 3.59 and 2.61 eV. The LiW defect with energy of formation of 2.14 eV was energetically the most favourable. For all dopants considered, while the HW induced no magnetic moment, the LiW and BeW induced magnetic moments of 3.44 and 0.05 μB, respectively. The band gap of the WTe2 as a result of the dopants was populated with several orbital ground states, and thus reduced within a few eV. While all XW behave as p - type dopant, the LiW defect posses half metallic character.
International Nuclear Information System (INIS)
Anderson, Lara B.; Gray, James; Raghuram, Nikhil; Taylor, Washington
2016-01-01
We explore a novel type of transition in certain 6D and 4D quantum field theories, in which the matter content of the theory changes while the gauge group and other parts of the spectrum remain invariant. Such transitions can occur, for example, for SU(6) and SU(7) gauge groups, where matter fields in a three-index antisymmetric representation and the fundamental representation are exchanged in the transition for matter in the two-index antisymmetric representation. These matter transitions are realized by passing through superconformal theories at the transition point. We explore these transitions in dual F-theory and heterotic descriptions, where a number of novel features arise. For example, in the heterotic description the relevant 6D SU(7) theories are described by bundles on K3 surfaces where the geometry of the K3 is constrained in addition to the bundle structure. On the F-theory side, non-standard representations such as the three-index antisymmetric representation of SU(N) require Weierstrass models that cannot be realized from the standard SU(N) Tate form. We also briefly describe some other situations, with groups such as Sp(3), SO(12), and SU(3), where analogous matter transitions can occur between different representations. For SU(3), in particular, we find a matter transition between adjoint matter and matter in the symmetric representation, giving an explicit Weierstrass model for the F-theory description of the symmetric representation that complements another recent analogous construction.
A Community Patient Demographic System
Gabler, James M.; Simborg, Donald W.
1985-01-01
A Community Patient Demographic System is described. Its purpose is to link patient identification, demographic and insurance information among multiple organizations in a community or among multiple registration systems within the same organization. This function requires that there be a competent patient identification methodology and clear definition of local responsibilities for number assignment and database editing.
Demographic Trends: Impact on Schools
Chong, Sylvia N. Y.; Cheah, Horn Mun
2010-01-01
Background: Singapore is experiencing great demographic change. These demographic trends show fewer young people and declining birth rates, greater longevity for ageing generations and an increase in the number of non-Singaporean residents. Statistics also show that more than half of the total population increase in the last decades was…
International Nuclear Information System (INIS)
He, Xiao; Ryu, Shinsei; Hirata, So
2014-01-01
Finite-temperature extensions of ab initio Gaussian-basis-set spin-restricted Hartree–Fock (HF) and second-order many-body perturbation (MP2) theories are implemented for infinitely extended, periodic, one-dimensional solids and applied to the Peierls and charge-density-wave (CDW) transitions in polyyne and all-trans polyacetylene. The HF theory predicts insulating CDW ground states for both systems in their equidistant structures at low temperatures. In the same structures, they turn metallic at high temperatures. Starting from the “dimerized” low-temperature equilibrium structures, the systems need even higher temperatures to undergo a Peierls transition, which is accompanied by geometric as well as electronic distortions from dimerized to non-dimerized forms. The conventional finite-temperature MP2 theory shows a sign of divergence in any phase at any nonzero temperature and is useless. The renormalized finite-temperature MP2 (MP2R) theory is divergent only near metallic electronic structures, but is well behaved elsewhere. MP2R also predicts CDW and Peierls transitions occurring at two different temperatures. The effect of electron correlation is primarily to lower the Peierls transition temperature
Knox meets Cox: adapting epidemiological space-time statistics to demographic studies.
Schmertmann, Carl P; Assuçãon, Renato M; Potter, Joseph E
2010-08-01
Many important questions and theories in demography focus on changes over time, and on how those changes differ over geographic and social space. Space-time analysis has always been important in studying fertility transitions, for example. However demographers have seldom used formal statistical methods to describe and analyze time series of maps. One formal method, used widely in epidemiology, criminology, and public health, is Knox 's space-time interaction test. In this article, we discuss the potential of the Knox test in demographic research and note some possible pitfalls. We demonstrate how to use familiar proportional hazards models to adapt the Knox test for demographic applications. These adaptations allow for nonrepeatable events and for the incorporation of structural variables that change in space and time. We apply the modified test to data on the onset offertility decline in Brazil over 1960-2000 and show how the modified method can produce maps indicating where and when diffusion effects seem strongest, net of covariate effects.
[The demographic potential of Russia].
Vishnevskii, A
1998-05-01
This is a general review of current demographic trends in Russia. The author analyzes the decline in population size that is taking place at the end of the twentieth century, and traces its origins as far back as the disturbances associated with World War I, the Communist revolution, and the civil war that followed it. Political repression during the Stalinist period and the tribulations experienced during World War II also contributed to the current demographic crisis. The author discusses the changes in migration patterns and the declining fertility and increasing mortality rates. The decline in life expectancy is also addressed. Some comparisons are made with the demographic situation in other European countries.
Directory of Open Access Journals (Sweden)
Angela Arruda
2009-12-01
Full Text Available Este texto pretende assinalar a relação da teoria psicossocial das representações sociais de Serge Moscovici com as ciências sociais, a partir da sua caracterização como uma abordagem de interpenetração da Psicologia com a Sociologia. Primeiramente fará uma breve análise sobre o trânsito entre Psicologia-Psicologia Social e Ciências Sociais, como um dos elementos de explicação para o entrecruzamento da Teoria das Representações Sociais (TRS com as ciências sociais. Em seguida pontuará como este entrecruzamento se coloca na abordagem moscoviciana, e como a TRS não escapa a ele. O argumento da autora é de que a base da relação entre essas áreas e a TRS está na concepção do social, presente no pensamento moscoviciano, o qual, ao mesmo tempo, não negligencia o quanto os aspectos psicológicos participam dos fatos sociais. O texto se encerra com alguns exemplos de pesquisa para ilustrar esta posição.This text intends to pinpoint the relationship between the psychosocial theory of social representations by Serge Moscovici and the social sciences, based on the characterization of this theory as an interpenetrative approach between psychology and sociology. Firstly, the transit between psychology-social psychology and sociology will be briefly presented as one of the elements that explain the intertwining of the Theory of Social Representations (TSR and social sciences. Next, it will be indicated how this intertwining is present in Moscovici's approach and how the TSR cannot escape it. The author's argument is that the relationship between these two fields is based on the conception of the social in Moscovici's thought, which does not neglect the importance of psychological aspects for social facts as well. The text concludes with some examples of research works that illustrate this point of view.
EJSCREEN Demographic Indicators 2015 Public
U.S. Environmental Protection Agency — EJSCREEN uses demographic factors as very general indicators of a community's potential susceptibility to the types of environmental factors included in this...
EJSCREEN Demographic Indicators 2016 Public
U.S. Environmental Protection Agency — EJSCREEN uses demographic factors as very general indicators of a community's potential susceptibility to the types of environmental factors included in this...
The age demographics of academic librarians a profession apart
Wilder, Stanley
2000-01-01
The Age Demographics of Academic Librarians: A Profession Apart discusses the current demographics of librarianship in North America and examines how a huge retiree rate will affect the profession. With the average age of librarians increasing dramatically since 1990, this book examines the changes that will have to take place in your library, such as recruiting, training, and working with a smaller staff. The Age Demographics of Academic Librarians provides you with insights on how to make your library's transition easier when several of your colleagues leave your library. Valuable and intelligent, The Age Demographics of Academic Librarians discusses trends through easy-to-read charts, tables, and comprehensive data analysis. Exploring possible reasons for the anomalies of this trend, this book explores several surprising facts, such as: 16 percent of the 1995 American Research Libraries population of librarians will retire by the year 2000, another 16 percent between 2000 and 2005, 24 percent between 2005 ...
Tolhoek, H.A.; Groot, S.R. de
The consequences of alignment of nuclei, which show allowed ß-transitions, are investigated. A general formula is derived for the transition probability of an allowed β-transition, in which the direction of emission of electron and neutrino, the polarization of the electron and the orientation of
Introduction to percolation theory
Stauffer, Dietrich
1991-01-01
Percolation theory deals with clustering, criticallity, diffusion, fractals, phase transitions and disordered systems. This book covers the basic theory for the graduate, and also professionals dealing with it for the first time
International Nuclear Information System (INIS)
Adler, S.L.; Wilczek, F.
1993-11-01
Areas of emphasis include acceleration algorithms for the Monte Carlo analysis of lattice field and gauge theories, quaternionic generalizations of complex quantum mechanics and field theory, application of the renormalization group to the QCD phase transition, the quantum Hall effect, and black holes. Other work involved string theory, statistical properties of energy levels in integrable quantum systems, baryon asymmetry and the electroweak phase transition, anisotropies of the cosmic microwave background, and theory of superconductors
Understanding the Demographic Differences in Neighborhood Walking Supports.
Carlson, Susan A; Watson, Kathleen B; Paul, Prabasaj; Schmid, Thomas L; Fulton, Janet E
2017-04-01
Information about how presence and usefulness of neighborhood supports for walking differs by demographic characteristics can help guide community strategies to promote walking. Reported presence and usefulness of neighborhood supports (shops, transit stops, sidewalks, parks, interesting things to look at, well-lit at night, low crime rate, and cars following speed limit) were examined in 3973 U.S. adults who completed the 2014 SummerStyles survey. Percentage reporting neighborhood supports as present ranged from 25.3% (SE = 0.8) for interesting things to 55.8% (SE = 1.0) for low crime rate. Percentage who reported a support as useful ranged from 24.6% (SE = 1.4) for transit stops to 79.0% (SE = 1.1) for sidewalks among those with the support. This percentage ranged from 13.4% (SE = 0.8) for transit stops to 52.8% (SE = 1.1) for shops among those without the support. One or more demographic differences were observed for the presence of each support, and the presence of all supports differed by education and metro status. Demographic patterns were less clear when examining usefulness and patterns often differed by support type and presence. Presence and usefulness of neighborhood supports for walking can differ by type and demographic characteristics. Recognizing these difference can help communities plan and implement strategies to promote walking.
Demographics in Astronomy and Astrophysics
Ulvestad, James S.
2011-05-01
Astronomy has been undergoing a significant demographic shift over the last several decades, as shown by data presented in the 2000 National Research Council (NRC) report "Federal Funding of Astronomical Research," and the 2010 NRC report, "New Worlds, New Horizons in Astronomy and Astrophysics." For example, the number of advertised postdoctoral positions in astronomy has increased much more rapldly than the number of faculty positions, contributing to a holding pattern of early-career astronomers in multiple postdoctoral positions. This talk will summarize some of the current demographic trends in astronomy, including information about gender and ethnic diversity, and describe some of the possible implications for the future. I thank the members of the Astro2010 Demographics Study Group, as well as numerous white-paper contributors to Astro2010, for providing data and analyses.
Social demographic change and autism.
Liu, Kayuet; Zerubavel, Noam; Bearman, Peter
2010-05-01
Parental age at child's birth--which has increased for U.S. children in the 1992-2000 birth cohorts--is strongly associated with an increased risk of autism. By turning a social demographic lens on the historical patterning of concordance among twin pairs, we identify a central mechanism for this association: de novo mutations, which are deletions, insertions, and duplications of DNA in the germ cells that are not present in the parents' DNA. Along the way, we show that a demographic eye on the rising prevalence of autism leads to three major discoveries. First, the estimated heritability of autism has been dramatically overstated. Second, heritability estimates can change over remarkably short periods of time because of increases in germ cell mutations. Third, social demographic change can yield genetic changes that, at the population level, combine to contribute to the increased prevalence of autism.
The demographic implications of nomadic herdsmen and farmers ...
African Journals Online (AJOL)
The paper examined the demographic implications resulting from nomadic herdsmen and farmers clashes in Nigeria. Relevant published texts across the country and the Malthusian theory provided the leverage for the study. It revealed that the Nigeria's population is dynamic and growing at a very rapid rate compared to ...
Child survival and the demographic "trap".
Kalish, S
1992-02-01
A debate within the UK public health community has centered around the feasibility of campaigns to improve child survival rates in Africa in the absence of equally aggressive efforts to increase family planning acceptance. The central spokesperson in this debate, Maurice King of the University of Leeds, has argued that population growth in sub-Saharan countries is undermining the carrying capacity of available resources and threatening ecological collapse. These countries are not exhibiting the characteristic demographic transition pattern, in which declining death rates eventually create conditions conducive to lower birth rates. Instead, they have fallen into a "demographic trap " in which population increases are outstripping growth in food production. To remedy this situation, King advocates the introduction of the concept of sustainability of the ecological foundations of health into the World Health Organizations's official definition of health. Richard Jolly of UNICEF has countered King's articles with the insistence that UNICEF has long supported child survival within the broader context of family planning provision and advocacy of birth spacing.
Are transition economy workers underpaid?
Adamchik, Vera A.; Brada, Josef C.; King, Arthur E.
2009-01-01
We examine the extent to which workers in transition and developed market economies are able to obtain wages that fully reflect their skills and labor force characteristics. We find that workers in two transition economies, the Czech Republic and Poland, are able to better attain the maximum wage available than are workers in a sample of developed market economies. This greater wage-setting efficiency in the transition economies ap-pears to be more the result of social and demographic charact...
Logistics Dynamics and Demographic Change
Klumpp, Matthias; Abidi, Hella; Bioly, Sascha; Buchkremer, Rüdiger; Ebener, Stefan; Sandhaus, Gregor; Freitag, Michael; Kotzab, Herbert; Pannek, Jürgen
2016-01-01
Change and dynamics in logistics are interestingly driven at the same time by external as well as internal forces. This contribution outlines a big data literature review methodology to overview recognizable external changes and analyzes the interaction of one major trend—demographic change—further
Are Demographics the Nation's Destiny?
Glass, Gene V.
2008-01-01
In this article, the author discusses the demographic trends affecting America's public schools. As an expert on empirical evaluation of education, the author believes the major debates over vouchers, charter schools, bilingual education, and other issues are not really about preparing the next generation to compete with China or India, or about…
Directory of Open Access Journals (Sweden)
Antonio da Cruz Gouveia Mendes
2012-05-01
Full Text Available Este estudo avalia a assistência hospitalar e ambulatorial e sua capacidade de responder às novas exigências neste contexto da transição demográfica brasileira. As informações foram obtidas dos estudos do IBGE, e sistemas de informações assistenciais do SUS (CNES, SIH e SIA. A redução das taxas de natalidade, fecundidade, mortalidade infantil e aumento da expectativa de vida ao nascer determinam ainda um crescimento demográfico, com redução da taxa de dependência, o que permite uma oportunidade para promover ajustes necessários. Entre 1999 e 2009, a população cresceu em mais 27,5 milhões de habitantes com redução de 26,7% dos leitos e 947 mil internações com distorções na distribuição por clínicas, mas com aumento da assistência de alta complexidade ambulatorial e hospitalar. Os resultados demonstram que vivemos um momento de transição do modelo assistencial que exige maior capacidade de planejamento do futuro da assistência à saúde, tornando mais complexa a rede assistencial e repensando o modelo de atenção à saúde, preparando-se para o grande crescimento da população idosa nas próximas décadas.This paper assesses inpatient and outpatient care and their capacity to respond to changing demands in the context of the demographic transition in Brazil. The data were obtained from studies by the Brazilian Institute of Geography and Statistics (IBGE and databases in the National Health System (CNES, SIH, and SIA. The reduction in birth, fertility, and infant mortality rates and the increase in life expectancy at birth are still driving population growth, while decreasing the dependency rate, thereby providing the opportunity to make necessary adjustments. The population increased by more than 27.5 million from 1999 to 2009, with a 26.7% reduction in hospital beds and 947,000 hospitalizations, with distortions in the distribution by specialty, but with increases in high-complexity outpatient and inpatient care
Demographic, social, and economic effects on Mexican causes of death in 1990.
Pick, J B; Butler, E W
1998-01-01
This study examined spatial geographic patterns of cause of death and 28 demographic and socioeconomic influences on causes of death for 31 Mexican states plus the Federal District for 1990. Mortality data were obtained from the state death registration system and are age standardized. The 28 socioeconomic variables were obtained from Census records. Analysis included 2 submodels: one with all 28 socioeconomic variables in a stepwise regression, and one with each of the 4 groups of factors. The conceptual model is based on epidemiological transition theory and empirical findings. There are 4 stages in mortality decline. Effects are grouped as demographic, sociocultural, economic prosperity, and housing, health, and crime factors. Findings indicate that cancer and cardiovascular disease were strongly correlated and consistently high in border areas as well as the Federal District and Jalisco. Respiratory mortality had higher values in the Federal District, Puebla, and surrounding states, as well as Jalisco. The standardized total mortality rate was only in simple correlations associated inversely with underemployment. All cause specific mortality was associated with individual factors. Respiratory mortality was linked with manufacturing work force. Cardiovascular and cancer mortality were associated with socioeconomic factors. In submodel I, cause specific mortality was predicted by crowding, housing characteristics, marriage and divorce, and manufacturing work force. In submodel II, economic group factors had the strongest model fits explaining 33-60% of the "r" square. Hypothesized effects were only partially validated.
Baby Boomers and Beds: a Demographic Challenge for the Ages.
Song, Zirui; Ferris, Timothy G
2018-03-01
The United States is facing a significant demographic transition, with about 10,000 baby boomers turning age 65 each day. At the same time, the nation is experiencing a similarly striking transition in hospital capacity, as the supply of hospital beds has declined in recent decades. The juxtaposition of population aging and hospital capacity portends a potentially widening divergence between supply and demand for hospital care. We provide a closer look at current hospital capacity and a rethinking of the future role of hospital beds in meeting the needs of an aging population.
Invariant probabilities of transition functions
Zaharopol, Radu
2014-01-01
The structure of the set of all the invariant probabilities and the structure of various types of individual invariant probabilities of a transition function are two topics of significant interest in the theory of transition functions, and are studied in this book. The results obtained are useful in ergodic theory and the theory of dynamical systems, which, in turn, can be applied in various other areas (like number theory). They are illustrated using transition functions defined by flows, semiflows, and one-parameter convolution semigroups of probability measures. In this book, all results on transition probabilities that have been published by the author between 2004 and 2008 are extended to transition functions. The proofs of the results obtained are new. For transition functions that satisfy very general conditions the book describes an ergodic decomposition that provides relevant information on the structure of the corresponding set of invariant probabilities. Ergodic decomposition means a splitting of t...
International Nuclear Information System (INIS)
Sachdev, S.
1999-01-01
Phase transitions are normally associated with changes of temperature but a new type of transition - caused by quantum fluctuations near absolute zero - is possible, and can tell us more about the properties of a wide range of systems in condensed-matter physics. Nature abounds with phase transitions. The boiling and freezing of water are everyday examples of phase transitions, as are more exotic processes such as superconductivity and superfluidity. The universe itself is thought to have passed through several phase transitions as the high-temperature plasma formed by the big bang cooled to form the world as we know it today. Phase transitions are traditionally classified as first or second order. In first-order transitions the two phases co-exist at the transition temperature - e.g. ice and water at 0 deg., or water and steam at 100 deg. In second-order transitions the two phases do not co-exist. In the last decade, attention has focused on phase transitions that are qualitatively different from the examples noted above: these are quantum phase transitions and they occur only at the absolute zero of temperature. The transition takes place at the ''quantum critical'' value of some other parameter such as pressure, composition or magnetic field strength. A quantum phase transition takes place when co-operative ordering of the system disappears, but this loss of order is driven solely by the quantum fluctuations demanded by Heisenberg's uncertainty principle. The physical properties of these quantum fluctuations are quite distinct from those of the thermal fluctuations responsible for traditional, finite-temperature phase transitions. In particular, the quantum system is described by a complex-valued wavefunction, and the dynamics of its phase near the quantum critical point requires novel theories that have no analogue in the traditional framework of phase transitions. In this article the author describes the history of quantum phase transitions. (UK)
Kumar, N.
2007-01-01
The recently observed (1) equipartition of current in parallel at and below the Normal-Superconducting (N-S) transition can be understood in terms of a Landau-Ginzburg order-parameter phenomenology. This complements the explanation proposed earlier (1) based on the flux-flow resistance providing a nonlinear negative current feedback towards equipartition when the transition is approached from above. The present treatment also unifies the usual textbook inductive subdivision expected much belo...
Fertility transition: forecast for demography.
Caputo, M; Nicotra, M; Gloria-Bottini, E
2008-08-01
By the end of the 20th century most industrialized nations had undergone the so-called fertility transition, characterized by a reduction in fertility to below replacement level and a delay in age at initiation of child-bearing. An emerging concern is the severe economic and social consequences of this demographic decline. We present an overview of fertility changes in Italy in the second half of the 20th century and a mathematical model that may provide projections for the future of the demographic situation. Starting in 1950 the increment of the number of children born in Italy is initially positive; however, beginning in 1965 the trend suddenly becomes negative, and this negative trend further increased in 1975. A slight improvement is observed in 1980, followed by a stable situation beginning in 1987. Relevant socioeconomic and cultural events in Italy coincide with these variations in the fertility trend. Malnutrition, which had been endemic for centuries in some areas of central and southern Italy, disappeared rather abruptly in early 1960. The improvement in the economic situation was also associated with a decrease in illiteracy and with many sociocultural changes, with the emergence of new demands that decreased propensity for childbearing. The additional deceleration observed in 1975 corresponds to the diffusion of contraceptive procedures. The progression of sociocultural changes has led to a progressive liberation of women from the biological burden of childbearing. Two phenomena seem relevant in this context: women's emerging interest in entering the workforce and the possibility to disconnect sex from childbearing. The social function of feminism has overwhelmed the primary function of survival and diffusion of the species, giving rise to relevant and worrying demographic effects. However, the modern woman has an unconscious memory of her primary biological role, depending on both her genetic structure and cultural heritage, that should bring about a
TOPICAL PROBLEMS: The phenomenological theory of world population growth
Kapitza, Sergei P.
1996-01-01
Of all global problems world population growth is the most significant. Demographic data describe this process in a concise and quantitative way in its past and present. Analysing this development it is possible by applying the concepts of systems analysis and synergetics, to work out a mathematical model for a phenomenological description of the global demographic process and to project its trends into the future. Assuming self-similarity as the dynamic principle of development, growth can be described practically over the whole of human history, assuming the growth rate to be proportional to the square of the number of people. The large parameter of the theory and the effective size of a coherent population group is of the order of 105 and the microscopic parameter of the phenomenology is the human lifespan. The demographic transition — a transition to a stabilised world population of some 14 billion in a foreseeable future — is a systemic singularity and is determined by the inherent pattern of growth of an open system, rather than by the lack of resources. The development of a quantitative nonlinear theory of the world population is of interest for interdisciplinary research in anthropology and demography, history and sociology, for population genetics and epidemiology, for studies in evolution of humankind and the origin of man. The model also provides insight into the stability of growth and the present predicament of humankind, and provides a setting for discussing the main global problems.
STATISTICAL EVALUATION OF THE IMPACT OF ECONOMIC FACTORS ON SOCIO-DEMOGRAPHICS OF THE COUNTRY
Directory of Open Access Journals (Sweden)
O. Evseenko
2014-04-01
Full Text Available In theory made a case the necessity of modeling economic and demographic indicators. The influences of economic, social and environmental indicators on social and demographic factors of development country are researeched. Given statistical evaluation of relationships based on correlation and regression analysis method.
Hypocritical transitions? The challenge of urban sustainable mobility transition
DEFF Research Database (Denmark)
Vogel, Nina
of a sustainable mobility discourse can be traced in the policy documents, how mobility is framed, and which arguments are used to legitimate or envision strategies and planning practices. Is Fredericia performing a transition towards low-carbon mobility? The paper will draw on concepts from transition theory...... urban complexity within transition processes. Transitions are always taking place, but the question is which direction they take and if these directions are in line with a planning approach for sustainable mobility....
Nel, Louis
2016-01-01
This book presents a detailed, self-contained theory of continuous mappings. It is mainly addressed to students who have already studied these mappings in the setting of metric spaces, as well as multidimensional differential calculus. The needed background facts about sets, metric spaces and linear algebra are developed in detail, so as to provide a seamless transition between students' previous studies and new material. In view of its many novel features, this book will be of interest also to mature readers who have studied continuous mappings from the subject's classical texts and wish to become acquainted with a new approach. The theory of continuous mappings serves as infrastructure for more specialized mathematical theories like differential equations, integral equations, operator theory, dynamical systems, global analysis, topological groups, topological rings and many more. In light of the centrality of the topic, a book of this kind fits a variety of applications, especially those that contribute to ...
Wang, Yaqun
2017-03-01
The authors are to be congratulated for a thought-provoking article [1], which reviews the epigenetic game theory (epiGame) that utilizes differential equations to study the epigenetic control of embryo development. It is a novel application of evolutionary game theory and provides biology researchers with useful methodologies to address scientific questions related to biological coordination of competition and cooperation.
Economic Effects of Demographic Ageing
Directory of Open Access Journals (Sweden)
Litra A.V.
2014-12-01
Full Text Available Romania goes through profound changes due to unprecedented demographic developments. As a result of declining birth rates and emigration after 1990, by the year 2060 is looming a possible doubling of the percentage of the population 65 years and over, from 15 to 30%, and the working age population to fall by about 30 percent. Deterioration of the relationship between labour force and inactive population leads to pressure on the public budget and tax system, strains on pension and social security systems, redefining consumer preferences, type and size of the saved or spent amounts, higher demand for healthcare services, increasing poverty risk for elderly households.
International Nuclear Information System (INIS)
Mack, G.
1982-01-01
After a description of a pure Yang-Mills theory on a lattice, the author considers a three-dimensional pure U(1) lattice gauge theory. Thereafter he discusses the exact relation between lattice gauge theories with the gauge groups SU(2) and SO(3). Finally he presents Monte Carlo data on phase transitions in SU(2) and SO(3) lattice gauge models. (HSI)
Zhang, Yuan-Ming; Zhang, Yinghao; Guo, Mingyue
2017-03-01
Wang's et al. article [1] is the first to integrate game theory (especially evolutionary game theory) with epigenetic modification of zygotic genomes. They described and assessed a modeling framework based on evolutionary game theory to quantify, how sperms and oocytes interact through epigenetic processes, to determine embryo development. They also studied the internal mechanisms for normal embryo development: 1) evolutionary interactions between DNA methylation of the paternal and maternal genomes, and 2) the application of game theory to formulate and quantify how different genes compete or cooperate to regulate embryogenesis through methylation. Although it is not very comprehensive and profound regarding game theory modeling, this article bridges the gap between evolutionary game theory and the epigenetic control of embryo development by powerful ordinary differential equations (ODEs). The epiGame framework includes four aspects: 1) characterizing how epigenetic game theory works by the strategy matrix, in which the pattern and relative magnitude of the methylation effects on embryogenesis, are described by the cooperation and competition mechanisms, 2) quantifying the game that the direction and degree of P-M interactions over embryo development can be explained by the sign and magnitude of interaction parameters in model (2), 3) modeling epigenetic interactions within the morula, especially for two coupled nonlinear ODEs, with explicit functions in model (4), which provide a good fit to the observed data for the two sexes (adjusted R2 = 0.956), and 4) revealing multifactorial interactions in embryogenesis from the coupled ODEs in model (2) to triplet ODEs in model (6). Clearly, this article extends game theory from evolutionary game theory to epigenetic game theory.
Relation Between Demographic Factors And Hospitalization In ...
African Journals Online (AJOL)
Relation Between Demographic Factors And Hospitalization In Patients With Gastrointestinal Disorders, Using Quantail Regression Analysis. ... East African Journal of Public Health ... Objective: The aim of this study is to investigate relation between demographic factors and hospitalization in gastrointestinal disorders.
Phase transitions modern applications
Gitterman, Moshe
2014-01-01
This book provides a comprehensive review of the theory of phase transitions and its modern applications, based on the five pillars of the modern theory of phase transitions i.e. the Ising model, mean field, scaling, renormalization group and universality. This expanded second edition includes, along with a description of vortices and high temperature superconductivity, a discussion of phase transitions in chemical reaction and moving systems. The book covers a close connection between phase transitions and small world phenomena as well as scale-free systems such as the stock market and the Internet. Readership: Scientists working in different fields of physics, chemistry, biology and economics as well as teaching material for undergraduate and graduate courses.
Jindal-Snape, D.; Miller, D. J.
2008-01-01
The transition from primary to secondary school can be a period of anxiety for many children. Although most schools have developed systems to ease this process, it has been argued that the emphasis is often on administrative and organisational procedures. In contrast, children and parents are typically more concerned with personal and social…
Impact of demographic policy on population growth.
Podyashchikh, P
1968-01-01
Various bourgeois theories, including the reactionary Malthusianism and its variants, challenge the Marxist-Leninist revolutionary theory on the growth of population. Bourgeois science maintains that unchanging biological laws of proliferation form the foundation of social life. Malthus, in his "An Essay on the Principle of Population," contends that population increases in a geometric rate, while means of subsistence tend to increase only in an arithmetic rate: neither the way of production nor social conditions but this law of nature in control of proliferation had been the cause of overpopulation, which again leads to misery, hunger, and unemployment. From this follows the possible conclusion that the working classes should be concerned not about how to change the social order but how to reduce the number of childbirths. Progressive science views the laws of social life in a totally different way. Marxism-Leninism teaches that population size, despite the markedly important role played by it in historical progress, fails to represent that main force of social progress which determines the mode of production and of the distribution of material goods, but just the reverse: the mode of production determines the growth of population, the changes in its density and composition. Marxism-Leninism teaches that each historical stage of production (slavery, feudalism, capitalism) has its own special, historically valid demographic law. Bourgeois science maintains that humankind faces an absolute overpopulation caused by the means of production lagging behind the growth of population. Actually this is only a relative overpopulation due to the fact that capitalistic production is subjected to the interests of increasing capitalistic profit and not to those of meeting the demands of population. In socialist countries, production is incessantly developing and expanding, and employment of the entire productive population is ensured. Consequently, the problem of relative
Demographic Ageing on Croatian Islands
Directory of Open Access Journals (Sweden)
Ivo Nejašmić
2013-08-01
Full Text Available This paper analyses the changes in the population structure of the Croatian islands by age, warns of the degree of ageing, provides spatial differentiation of this process and presents perspective of ageing at the level of settlement. Typing of population ageing is based on scores and has seven types. The total island population in 2011 belongs to the type 5 – very old population. Almost a half of the settlements (out of 303 have been affected by the highest levels of ageing (types 6 and 7. It was found that a quarter of island settlements will become “dead villages” in a foreseeable future; most of them are on small islands but also in the interior of larger islands. These are villages decaying in every respect, in which the way of life, as we know it, veins and goes out. The present ageing villagers are their last residents in most cases. Eve¬rything suggests that demographic recovery of the islands is not possible with the forces in situ. It is important to strike a balance between the needs and opportunities in order to successfully organize life on the islands, both small and large ones, and the fact is that there is a continuing disparity, which is especially profound in small islands. A sensitive and selective approach is needed to overcome the unfavourable demographic trends. Therefore it is necessary to respect the particularities of indi¬vidual islands and island groups in devising development strategy. Solutions to the problems must come of the local and wider community in synergy with relevant professional and scientific institutions. However, if the solutions are not found or measures do not give results, if the islands are left to desorganisation and senilisation, a part of the islands will become a wasteland. With regard to the value of this area whose wealth are people in the first place, this would be an intolerable civilization decline.
Kopaev, YuV
1992-01-01
Electronic Phase Transitions deals with topics, which are presently at the forefront of scientific research in modern solid-state theory. Anderson localization, which has fundamental implications in many areas of solid-state physics as well as spin glasses, with its influence on quite different research activities such as neural networks, are two examples that are reviewed in this book. The ab initio statistical mechanics of structural phase transitions is another prime example, where the interplay and connection of two unrelated disciplines of solid-state theory - first principle ele
Wu, Song
2017-03-01
Qian Wang et al. present an interesting framework, named epigenetic game theory, for modeling sex-based epigenetic dynamics during embryogenesis from a new viewpoint of evolutionary game theory [1]. That is, epigenomes of sperms and oocytes may coordinate through either cooperation or competition, or both, to affect the fitness of embryos. The work uses a set of ordinary differential equations (ODEs) to describe longitudinal trajectories of DNA methylation levels in both parental and maternal gametes and their dependence on each other. The insights gained from this review, i.e. dynamic methylation profiles and their interaction are potentially important to many fields, such as biomedicine and agriculture.
Czech Academy of Sciences Publication Activity Database
Pittner, Jiří
2003-01-01
Roč. 118, č. 24 (2003), s. 10876-10889 ISSN 0021-9606 R&D Projects: GA MŠk OC D23.001; GA ČR GA203/99/D009; GA AV ČR IAA4040108 Institutional research plan: CEZ:AV0Z4040901 Keywords : continuous transition * Brillouin-Wigner * Rayleigh-Schrödinger Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 2.950, year: 2003
Asia's demographic miracle: 50 years of unprecedented change.
Leete, R; Alam, I
1999-12-01
The demographic landscape of Asia has seen unprecedented changes over the past 50 years. The transition from high to low mortality and fertility rates has made the eventual stabilization of the world's population a real possibility. The demographic success of Asia is associated with the stunning economic and social changes that have taken place during this period. Aside from social and economic improvements, population and health policies also played a major part in shaping the region's demographic transformation. National programs made a substantial contribution to increasing contraceptive use, lowering fertility, and slowing population growth. The success of family planning programs was frequently supported by positive changes in the demand for children. As the initial impact of the recent financial and economic crisis has shown, the Asian demographic miracle cannot be taken for granted. Since mid-1997, the crisis has interrupted and reversed the region's remarkable development gains. Economic downturns often tend to affect the social sectors unevenly. Strengthening the provision of basic social services, including reproductive health and care of the elderly, particularly in poor nations, will remain a challenge in the next century. The establishment of goals, including in areas such as HIV/AIDS, will help Asian countries realize the vision of the International Conference on Population and Development¿s 20-year Programme of Action.
International Nuclear Information System (INIS)
Ertaş, Mehmet; Keskin, Mustafa; Deviren, Bayram
2012-01-01
Using an effective field theory with correlations, we study a kinetic spin-5/2 Blume–Capel model with bilinear exchange interaction and single-ion crystal field on a square lattice. The effective-field dynamic equation is derived by employing the Glauber transition rates. First, the phases in the kinetic system are obtained by solving this dynamic equation. Then, the thermal behavior of the dynamic magnetization, the hysteresis loop area and correlation are investigated in order to characterize the nature of the dynamic transitions and to obtain dynamic phase transition temperatures. Finally, we present the phase diagrams in two planes, namely (T/zJ, h 0 /zJ) and (T/zJ, D/zJ), where T absolute temperature, h 0 , the amplitude of the oscillating field, D, crystal field interaction or single-ion anisotropy constant and z denotes the nearest-neighbor sites of the central site. The phase diagrams exhibit four fundamental phases and ten mixed phases which are composed of binary, ternary and tetrad combination of fundamental phases, depending on the crystal field interaction parameter. Moreover, the phase diagrams contain a dynamic tricritical point (T), a double critical end point (B), a multicritical point (A) and zero-temperature critical point (Z). - Highlights: ► The effective-field theory is used to study the kinetic spin-5/2 Ising Blume–Capel model. ► Time variations of average order parameter have been studied to find phases in the system. ► The dynamic magnetization, hysteresis loop area and correlation have been calculated. ► The dynamic phase boundaries of the system depend on D/zJ. ► The dynamic phase diagrams are presented in the (T/zJ, h 0 /zJ) and (D/zJ, T/zJ) planes.
Energy Technology Data Exchange (ETDEWEB)
Ertas, Mehmet [Department of Physics, Erciyes University, 38039 Kayseri (Turkey); Keskin, Mustafa, E-mail: keskin@erciyes.edu.tr [Department of Physics, Erciyes University, 38039 Kayseri (Turkey); Deviren, Bayram [Department of Physics, Nevsehir University, 50300 Nevsehir (Turkey)
2012-04-15
Using an effective field theory with correlations, we study a kinetic spin-5/2 Blume-Capel model with bilinear exchange interaction and single-ion crystal field on a square lattice. The effective-field dynamic equation is derived by employing the Glauber transition rates. First, the phases in the kinetic system are obtained by solving this dynamic equation. Then, the thermal behavior of the dynamic magnetization, the hysteresis loop area and correlation are investigated in order to characterize the nature of the dynamic transitions and to obtain dynamic phase transition temperatures. Finally, we present the phase diagrams in two planes, namely (T/zJ, h{sub 0}/zJ) and (T/zJ, D/zJ), where T absolute temperature, h{sub 0}, the amplitude of the oscillating field, D, crystal field interaction or single-ion anisotropy constant and z denotes the nearest-neighbor sites of the central site. The phase diagrams exhibit four fundamental phases and ten mixed phases which are composed of binary, ternary and tetrad combination of fundamental phases, depending on the crystal field interaction parameter. Moreover, the phase diagrams contain a dynamic tricritical point (T), a double critical end point (B), a multicritical point (A) and zero-temperature critical point (Z). - Highlights: Black-Right-Pointing-Pointer The effective-field theory is used to study the kinetic spin-5/2 Ising Blume-Capel model. Black-Right-Pointing-Pointer Time variations of average order parameter have been studied to find phases in the system. Black-Right-Pointing-Pointer The dynamic magnetization, hysteresis loop area and correlation have been calculated. Black-Right-Pointing-Pointer The dynamic phase boundaries of the system depend on D/zJ. Black-Right-Pointing-Pointer The dynamic phase diagrams are presented in the (T/zJ, h{sub 0}/zJ) and (D/zJ, T/zJ) planes.
Renormalization group approach to QCD phase transitions
International Nuclear Information System (INIS)
Midorikawa, S.; Yoshimoto, S.; So, H.
1987-01-01
Effective scalar theories for QCD are proposed to investigate the deconfining and chiral phase transitions. The orders of the phase transitions are determined by infrared stabilities of the fixed points. It is found that the transitions in SU(3) gauge theories are of 1st order for any number of massless flavors. The cases of SU(2) and SU(4) gauge theories are also discussed. (orig.)
DEFF Research Database (Denmark)
Gissel, Line Engbo
This presentation builds on an earlier published article, 'Contemporary Transitional Justice: Normalising a Politics of Exception'. It argues that the field of transitional justice has undergone a shift in conceptualisation and hence practice. Transitional justice is presently understood to be th...... to be the provision of ordinary criminal justice in contexts of exceptional political transition.......This presentation builds on an earlier published article, 'Contemporary Transitional Justice: Normalising a Politics of Exception'. It argues that the field of transitional justice has undergone a shift in conceptualisation and hence practice. Transitional justice is presently understood...
International Nuclear Information System (INIS)
Kasteleyn, P.W.
1971-01-01
Apology. 1. Order-disorder transitions; 2. The Ising model; 3. The classical theories; 4. The exact analysis of the Ising model; 5. Series expansions; 6. Relations between critical indices; 7. Other models; 8. Concluding remarks. (author)
CONSEQUENCES OF THE DEMOGRAPHIC CRISIS
Directory of Open Access Journals (Sweden)
LIVIU RADU
2014-11-01
Full Text Available Major dysfunctionalities can arise from the demographic decline, both on a social level and from the perspective of the economic-financial evolution of the world’s states. The obvious aging of the industrialized states’ population overlapping the import of cheap workforce in the developing countries can start mutations whose consequences are somewhat predictable but discouraging. An accelerated urbanization of the states is foreseen, as well as the decrease of birthrates, negative external migration, increase of mortality and its stagnation in a larger value than that of the birthrate, and not least the population’s aging will hinder a part of the developing countries to sustain a high rhythm of long-term economical increase. The socialeconomic consequences will be reflected in the labor market, the householders’ amount of income as well as in the education’s level. All of these aspects call for a rethinking of the public politics, especially of the social insurance’s system and of the education, a reorientation of the economy based on the increase of specializing in production and productivity, as well as a financial stability unburdened by the politics’ interference in the business environment.
Public health and demographic statistics
International Nuclear Information System (INIS)
Patrick, C.H.; Loebl, A.S.; Miller, F.L.; Ritchey, P.N. Jr.
1976-01-01
The purpose of this program is to assess the methodology and available data sources appropriate for use in analytical studies and environmental impact statements concerning the health effects of nuclear power plants. The techniques developed should be applicable as well to evaluation of the known risks of high levels of radiation exposure and of conflicting evidence on low-level effects, such as those associated with the normal operations of nuclear power plants. To accomplish this purpose, a two-pronged approach has been developed. The first involves a determination of the public health and demographic data sources of local, state, and federal origin that are available for use in analyses of health effects and environmental impact statements. The second part involves assessment of the methods used by epidemiologists, biostatisticians, and other scientists as found in the literature on health effects. This two-pronged approach provides a means of assessing the strength and shortcomings of studies of the impact of nuclear facilities on the health of the general population in a given locality
Crenshaw, Edward; Robison, Kristopher
2010-01-01
This study establishes a socio-demographic theory of international development derived from selected classical and contemporary sociological theories. Four hypotheses are tested: (1. population growth's effect on development depends on age-structure; (2. historic population density (used here as an indicator of preindustrial social complexity)…
Nonrelativistic closed string theory
International Nuclear Information System (INIS)
Gomis, Jaume; Ooguri, Hirosi
2001-01-01
We construct a Galilean invariant nongravitational closed string theory whose excitations satisfy a nonrelativistic dispersion relation. This theory can be obtained by taking a consistent low energy limit of any of the conventional string theories, including the heterotic string. We give a finite first order worldsheet Hamiltonian for this theory and show that this string theory has a sensible perturbative expansion, interesting high energy behavior of scattering amplitudes and a Hagedorn transition of the thermal ensemble. The strong coupling duals of the Galilean superstring theories are considered and are shown to be described by an eleven-dimensional Galilean invariant theory of light membrane fluctuations. A new class of Galilean invariant nongravitational theories of light-brane excitations are obtained. We exhibit dual formulations of the strong coupling limits of these Galilean invariant theories and show that they exhibit many of the conventional dualities of M theory in a nonrelativistic setting
Using demographic data to better interpret pitfall trap catches.
Matalin, Andrey V; Makarov, Kirill V
2011-01-01
The results of pitfall trapping are often interpreted as abundance in a particular habitat. At the same time, there are numerous cases of almost unrealistically high catches of ground beetles in seemingly unsuitable sites. The correlation of catches by pitfall trapping with the true distribution and abundance of Carabidae needs corroboration. During a full year survey in 2006/07 in the Lake Elton region (Volgograd Area, Russia), 175 species of ground beetles were trapped. Considering the differences in demographic structure of the local populations, and not their abundances, three groups of species were recognized: residents, migrants and sporadic. In residents, the demographic structure of local populations is complete, and their habitats can be considered "residential". In migrants and sporadic species, the demographic structure of the local populations is incomplete, and their habitats can be considered "transit". Residents interact both with their prey and with each other in a particular habitat. Sporadic species are hardly important to a carabid community because of their low abundances. The contribution of migrants to the structure of carabid communities is not apparent and requires additional research. Migrants and sporadic species represent a "labile" component in ground beetles communities, as opposed to a "stable" component, represented by residents. The variability of the labile component substantially limits our interpretation of species diversity in carabid communities. Thus, the criteria for determining the most abundant, or dominant species inevitably vary because the abundance of migrants in some cases can be one order of magnitude higher than that of residents. The results of pitfall trapping adequately reflect the state of carabid communities only in zonal habitats, while azonal and disturbed habitats are merely transit ones for many species of ground beetles. A study of the demographic structure of local populations and assessment of the
Corzo, H. H.; Velasco, A. M.; Lavín, C.; Ortiz, J. V.
2018-02-01
Vertical excitation energies belonging to several Rydberg series of MgH have been inferred from 3+ electron-propagator calculations of the electron affinities of MgH+ and are in close agreement with experiment. Many electronically excited states with n > 3 are reported for the first time and new insight is given on the assignment of several Rydberg series. Valence and Rydberg excited states of MgH are distinguished respectively by high and low pole strengths corresponding to Dyson orbitals of electron attachment to the cation. By applying the Molecular Quantum Defect Orbital method, oscillator strengths for electronic transitions involving Rydberg states also have been determined.
Transition-Systems, Event Structures, and Unfoldings
DEFF Research Database (Denmark)
Nielsen, Mogens; Rozenberg, Grzegorz; Thiagarajan, P.S.
1995-01-01
systems. Here we show that by smoothly strengthening the regional axioms for elementary transition systems, one obtains a subclass called occurrence transition system. We then prove that occurrence transition systems are the transition system model of yet another basic model of concurrency, namely, prime......A subclass of transition systems called elementary transition systems can be identified with the help of axioms based on a structural notion called regions. Elementary transition systems have been shown to be the transition system model of a basic system model of net theory called elementary net...
Phase transitions and quantum entropy
International Nuclear Information System (INIS)
Arrachea, L.; Canosa, N.; Plastino, A.; Portesi, M.; Rossignoli, R.
1990-01-01
An examination is made of the possibility to predict phase transitions of the fundamental state of finite quantum system, knowing the quantum entropy of these states, defined on the basis of the information theory. (Author). 7 refs., 3 figs
Gender inequalities and demographic behavior.
1995-01-01
A summary was provided of the central findings about gender inequalities in Egypt, India, Ghana, and Kenya published by the Population Council in 1994. These countries exhibited gender inequalities in different ways: the legal, economic, and educational systems; family planning and reproductive health services; and the health care system. All countries had in common a high incidence of widowhood. Widowhood was linked with high levels of insecurity, which were linked with high fertility. Children thus became insurance in old age. In Ghana, women's insecurity was threatened through high levels of marital instability and polygyny. In Egypt, insecurity was translated into economic vulnerability because of legal discrimination against women when family systems were disrupted. In India and all four countries, insecurity was reflective of limited access to education, an impediment to economic autonomy. In all four countries, women's status was inferior due to limited control over reproductive decision making about childbearing limits and contraception. In India, the cultural devaluation of girls contributed to higher fertility to satisfy the desire for sons. In India and Egypt, family planning programs were dominated by male-run organizations that were more concerned about demographic objectives than reproductive health. The universal inequality was the burden women carry for contraception. Family planning programs have ignored the local realities of reproductive behavior, family structures, and gender relations. The assumption that husbands and wives have similar fertility goals or that fathers fully share the costs of children is mistaken in countries such as Ghana. Consequently, fertility has declined less than 13% in Ghana, but fertility has declined by over 30% in Kenya. Family planning programs must be aware of gender issues.
[Maternal mortality: the demographic aspects].
Sanogo, D
1989-10-01
The World Health Organization (WHO) has defined maternal mortality (MM) as a death following a delivery or during the 42 day period following a prolonged or complicated delivery. This definition is ambiguous because it does not take into account the institutional causes (deficiencies) that lead to MM in Sub-Saharan Africa (SSA) nor does it reflect all the reasons leading to MM because of the lack of nationwide health information systems and the lack of accurate statistics. While developed countries can depend on the state to provide accurate statistics, developing countries depend on hospitals, health training centers and special surveys to provide such data which often leads to 25-50% gross underestimations of MM. The most recent WHO data (1989) shows that SSA has the highest MM rates worldwide, ranging from 500- 700/100,000 as compared to Asia with 55-650; Latin America with 110-210 and the developed countries with 10-48. The data for SSA doesn't reflect the true situation in the rural areas where MM rates are over 1000/1000,000. MM is a symptom of poor countries where women contribute to their own deaths through repeated pregnancies, causing significant socioeconomic losses to society. UNICEF (1988) has categorized the demographic factors as high risk for women based on: 1) the age of the mother, and 2) the number of pregnancies. Family planning (FP) reduces MM by preventing illegal abortions; it reduces the number of unwanted pregnancies and increases the earnings of a community by reducing the number of pregnant women. The experience of developed countries demonstrates how women have avoided high-risk and unwanted pregnancies.
Energy Technology Data Exchange (ETDEWEB)
Mukherji, Debashish; Stuehn, Torsten; Kremer, Kurt [Max-Planck Institut für Polymerforschung, Ackermannweg 10, 55128 Mainz (Germany); Marques, Carlos M. [Max-Planck Institut für Polymerforschung, Ackermannweg 10, 55128 Mainz (Germany); Institut Charles Sadron, Université de Strasbourg, CNRS, Strasbourg (France)
2015-03-21
Smart polymers are a modern class of polymeric materials that often exhibit unpredictable behavior in mixtures of solvents. One such phenomenon is co-non-solvency. Co-non-solvency occurs when two (perfectly) miscible and competing good solvents, for a given polymer, are mixed together. As a result, the same polymer collapses into a compact globule within intermediate mixing ratios. More interestingly, polymer collapses when the solvent quality remains good and even gets increasingly better by the addition of the better cosolvent. This is a puzzling phenomenon that is driven by strong local concentration fluctuations. Because of the discrete particle based nature of the interactions, Flory-Huggins type mean field arguments become unsuitable. In this work, we extend the analysis of the co-non-solvency effect presented earlier [D. Mukherji et al., Nat. Commun. 5, 4882 (2014)]. We explain why co-non-solvency is a generic phenomenon, which can only be understood by the thermodynamic treatment of the competitive displacement of (co)solvent components. This competition can result in a polymer collapse upon improvement of the solvent quality. Specific chemical details are not required to understand these complex conformational transitions. Therefore, a broad range of polymers are expected to exhibit similar reentrant coil-globule-coil transitions in competing good solvents.