Understanding Molecular Simulation: From Algorithms to Applications explains the physics behind the "recipes" of molecular simulation for materials science. Computer simulators are continuously confronted with questions concerning the choice of a particular technique for a given application. A wide variety of tools exist, so the choice of technique requires a good understanding of the basic principles. More importantly, such understanding may greatly improve the efficiency of a simulation program. The implementation of simulation methods is illustrated in pseudocodes and their practical use in the case studies used in the text. Since the first edition only five years ago, the simulation world has changed significantly -- current techniques have matured and new ones have appeared. This new edition deals with these new developments; in particular, there are sections on: - Transition path sampling and diffusive barrier crossing to simulaterare events - Dissipative particle dynamic as a course-grained simulation technique - Novel schemes to compute the long-ranged forces - Hamiltonian and non-Hamiltonian dynamics in the context constant-temperature and constant-pressure molecular dynamics simulations - Multiple-time step algorithms as an alternative for constraints - Defects in solids - The pruned-enriched Rosenbluth sampling, recoil-growth, and concerted rotations for complex molecules - Parallel tempering for glassy Hamiltonians Examples are included that highlight current applications and the codes of case studies are available on the World Wide Web. Several new examples have been added since the first edition to illustrate recent applications. Questions are included in this new edition. No prior knowledge of computer simulation is assumed.
This new issue in our leadership series provides you with a comprehensive analysis of management practices in Australia, Azerbaijan, Belarus, China, Dominican Republic , Finland, France, Ghana, Ireland, Italy, Morocco, New Zealand, Romania, Suriname, Sweden and Vietnam. This book shows how domestic leadership conventions often differ significantly from those in other countries. Comparative desk research, focus interviews with, and online polling of thousands of C-level professionals in the aforementioned countries, made us realise how much cultural factors can affect leadership strategies across the globe. A book providing a reference for those aiming at a cross-border career, or interested in international management issues. Alwin van der Blom ; امل المنوتي (Amal El Mannouti) ; Анастасия Сафонова (Anastasiya Safonava) ; Aryan Ghanizadeh ; Bas Aartsma ; Bibi Kor ; Boaz Kuijer ; Bram de Kloet ; Bram Verburg ; Bùi Ngọc Diệu Thảo ; Celeste Dorigo ; Charlotte Boakye ; Daan van der Schot ; Daley Claassen ; Dennis Mosch ; Erik Kaal ; Fleur Leijtens ; Inge Trakzel ; Jary Nijssen ; Jasper van Beek ; Jeroen van Duin ; Jesse Buiter ; 彭竞雨 (Jingyu Peng) ; Jorrit van den Berg ; Julian van Arkel ; Juno Bäckman ; Kassandre Maginot ; Kevin van Balen ; Койна Стоянова (Koina Stoyanova) ; Kristy Bruijn ; Lisa Straalman ; Luciano Tetelepta ; मनीषा रसियावन (Manisha Rasiawan) ; Margot Amouroux-Prince ; Maria Simões Fortini Sidney de Souza ; Marije Hollestelle ; Marissa Bank ; Mark Grasmayer ; Mark Hoogenraat ; Martijn Smeets ; Maurice Backer Dirks ; Maxime Requin ; Megena Tesfamariam ; Michelle Vet ; Myrtill Dongen Natalia Kempny ; نورهان الخفاجي (Norhan Al Khafaji) ; Omar Fye ; Patricia Okarimia ; Patrick Kat ; Patrick Peute ; Raphael Gounod-Rondepierre ; Rens Geertse ; Ruben den Bak ; Rudmer Lieshout ; Rynk Poelsma ; Sam van Diest ; Sammie Reijnders ; Sem van Amersfoort ; Sil Visser ; Sophie Klijn ; Stefanie Ozuna Castillo ; Susanne Koelman ; Sven Spiegelenberg ; Teun Hoogland ; Tibor Lundberg ; Tim Eliasson ; Titta Pennanen ; Tjeerd Phaff ; Victoria Ricknell ; Vlada Sacara and 张洋帆 (Yvonne, Yangfan Zhang).
Engaging with debates about lived religion, pluralism, and secularism, this book presents an ethnographic study of committed young Muslims and Christians in the predominantly secular context of the Netherlands. Daan Beekers breaks with conventional frameworks that keep these groups apart by highlighting the common ground between revivalist-minded Protestant Christians and Sunni Muslims. Based on in-depth fieldwork, Young Muslims and Christians in a Secular Europe shows that these young adults embark on reflexive projects of cultivating personal faith that are rife with struggles, setbacks, and doubts. Beekers argues that this shared precarious condition of everyday religious pursuits is shaped by young believers' active participation in today's high capitalist and largely secular society where they encounter other modes of imagining and living in the world. Yet he reveals that this close engagement with secular culture also fosters a reinvigorated religious commitment that demands constant care and nourishment. Written in a clear and accessible style, this book reaches beyond longstanding divisions in the study of religion in Europe. It both provides rich insights into everyday religious lives and disrupts persistent binary oppositions between categories such as minorities and majorities, migrants and natives, and Islam and the West.
In the 1940s I was struck by reports about many apparently healthy middle-aged men who dropped dead instantly from heart attacks. The causes of these sudden deaths were unknown. I was interested to discover physio-chemical characteristics of individuals with predictive value for the occurrence of these fatal heart attacks. The discovery ofpreventive variables would point ways to prevent this disease. In order to find relationships between mode of life and susceptibility to heart disease contrasting populations had to be studied. Variety - not a high degree of homogeneity in culture and habits - must be sought. After exploratory surveys in countries with supposed differences in dietary patterns, lifestyle and heart disease rates in the early 1950s, the Seven Countries Study took off in 1958. This study established relationships between risk factors and development of heart disease in middle-aged men in health examined in countries with cultures we demonstrated to contrast in diet and lifestyle. The results obtained in the Seven Countries Study from its inception till now are presented in this book entitled: "Prevention ofcoronary heart disease. Diet, lifestyle and risk factors in the Seven Countries Study. " Long ago I realized that our concern should not be restricted to the prevention of coronary heart disease but should be extended to all diseases and premature death.
Lilies of the field . . . thorns by the wayside . . . plants that grew in the lands of the Bible? What lies behind the familiar symbolism of the lilies, thorns, vines, and other plants mentioned in the Bible? This book delves into questions that have fascinated people through the ages and brings to life some of the most memorable phrases of the Bible. Line and full-color illustrations throughout.
Understanding Molecular Simulation explains molecular simulation from a chemical-physics and statistical-mechanics perspective. It highlights how physical concepts are used to develop better algorithms and expand the range of applicability of simulations. Understanding Molecular Simulation is equally relevant for those who develop new code and those who use existing packages. Both groups are continuously confronted with the question of which computational technique best suits a given application. Understanding Molecular Simulation provides readers with the foundational knowledge they need to learn about, select and apply the most appropriate of these tools to their own work. The implementation of simulation methods is illustrated in pseudocodes, and their practical use is shown via case studies presented throughout the text. Since the second edition's publication, the simulation world has expanded significantly: existing techniques have continued to develop, and new ones have emerged, opening up novel application areas. This new edition aims to describe these new developments without becoming exhaustive; examples are included that highlight current uses, and several new examples have been added to illustrate recent applications. Examples, case studies, questions, and downloadable algorithms are also included to support learning. No prior knowledge of computer simulation is assumed. - Fully updated guide to both the current state and latest developments in the field of molecular simulation, including added and expanded information on such topics as molecular dynamics and statistical assessment of simulation results - Gives a rounded overview by showing fundamental background information in practice via new examples in a range of key fields - Provides online access to new data, algorithms and tutorial slides to support and encourage practice and learning
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