Quantum and theoretical chemistry

Fundamentals of Continuum Mechanics of Soils provides a long-needed general scheme for the study of the important yet problematic material of soil.

Supramolecular chemistry deals with the organisation of molecules into defined assemblies using non-covalent interactions, including weaker and reversible interactions such as hydrogen bonds, and metal-ligand interactions.

The present work offers a snapshot of the state-of-the-art of crystallographic, analytical, and computational methods used in modern drug design and development.

Practical Aspects of Computational Chemistry I: An Overview of the Last Two Decades and Current Trends gathers the advances made within the last 20 years by well-known experts in the area of theoretical and computational chemistry and physics.

Few religious traditions have generated such diversity and stirred imaginations as shamanism.

This monograph focuses on the mathematical and numerical analysis of simplicial partitions and the finite element method.

The field of atomic clusters continues to attract great interest amongst physicists and chemists alike.

Advances in Quantum Chemistry presents surveys of current topics in this rapidly developing field that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry, and biology.

Our aim in this book is to present and enlarge upon those aspects of parallel computing that are needed by practitioners of computational science.

Through the 'dark night of the soul' to the depiction of the erotically-charged union of the soul and God, the poetry and prose works of the Spanish friar John of the Cross (1542-1591) offer a striking account of the transformation of the individual in the course of the Christian life.

This book presents the state-of-the-art in supercomputer simulation.

*; Fox marries mysticism with social justice, leading the way toward a gentler and more ecological spirituality and an acceptance of our interdependence*; A road map to fulfillment for the coming centuryIn A Spirituality Named Compassion, Matthew Fox, the popular and controversial author, establishes a spirituality for the future that promises personal, social, and global healing.

The Oxford Handbook of Mystical Theology provides a guide to the mystical element of Christianity as a theological phenomenon.

This book summarizes the state of the art in the theoretical modeling of inorganic nanostructures.

This book highlights the need for studying multi-state models analytically for understanding the physics of molecular processes.

Written by leading experts in this field, this proceedings volume originates from a workshop held in Toulouse on March 1-2, 2023, organized by the ESIM European project (Energy Storage Inside Molecule(s)).

A groundbreaking look at the phenomenon of the labyrinth, connecting this ancient symbol to modern scientific principles.

*; Traces the life of Maurice Nicoll, who left a successful career as a psychiatrist in 1922 to study with G.

The author wrote a monograph 20 years ago on the construction of spin eigen- functions; the monograph was published by Plenum.

This book highlights important aspects of nonlinear dynamics of biophysical nanosystems, such as DNA, alpha helix, and microtubules.

Für die Planung, Durchführung und Auswertung wissenschaftlicher Studien bietet die siebte, überarbeitete Auflage mit zahlreichen Übersichten überzeugende Arbeitshilfen, die auch die üblichen Software-Pakete in wesentlichen Details ergänzen.

This book introduces the application of computational homology for structural analysis of metallic glasses.

Tauchen Sie ein in die faszinierende Welt der Rosenkreuzer, einer der geheimnisvollsten und einflussreichsten esoterischen Bewegungen der Geschichte.

The electron density of a non-degenerate ground state system determines essentially all physical properties of the system.

Known for his deeply mystical writings about Christianity, Nicholas of Cusa wrote this, his most popular work, against a backdrop of widespread Church corruption.

"e;Chemists familiar with conventional quantum mechanics will applaud and benefit greatly from this particularly instructive, thorough and clearly written exposition of density functional theory: its basis, concepts, terms, implementation, and performance in diverse applications.

This book provides deep insight into the physical quantity known as chemical activity.

In the course of 30 years as a practicing crystallographer I have frequently been faced with the necessity of finding out a little bit about some general branch of mathematics with which I was previously unfamiliar.

1 Aims and Features of This Book The contents of t.

Self-propelled objects (particles, droplets) are autonomous agents that can convert energy from the environment into motion.

Questo libro racconta la storia di una bambina nel corso di una calamità globale che colpisce il pianeta in cui vive.

Das Buch behandelt die heutige roboterorientierte Programmierung mit Roboterprogrammiersprachen und stellt wichtige Konzepte der zukünftigen aufgabenorientierten Programmierung intelligenter Roboter dar, z.

Any description of the workings of nature by means of measurements and ob- servations is beset with the problem of how to cope with an immense amount of information.

This book covers a range of topics in quantum mechanics and molecular dynamics simulation, including computational modeling and machine learning approaches.

Examines the left-hand path and reveals the masters of the tradition *; Explores the practices and beliefs of many left-hand path groups, including the Cult of Set, the Hell-Fire Club, and heretical Sufi, Zoroastrian, Christian, and Muslim sects *; Investigates many infamous occult personalities, including Helena Blavatsky, Aleister Crowley, the Marquis de Sade, and Anton LaVey *; Explains the true difference between the right-hand path and the left-hand path--union with and dependence on God versus individual freedom and self-empowerment From black magic and Satanism to Gnostic sects and Gurdjieff's Fourth Way, the left-hand path has been linked to many practices, cults, and individuals across the ages.

This volume contains the proceedings of the Workshop on Com- bustion, sponsored by the Institute for Computer Applications in Science and Engineering (ICASE) and the NASA Langley Research Center (LaRC).

Die Studie zur Frauenkorrespondenz Anselms von Canterbury entdeckt den großen Denker und Kirchenpolitiker als feinsinnigen Seelsorger.

The monograph series Oxford Studies in Medieval Literature and Culture showcases the plurilingual and multicultural quality of medieval literature and actively seeks to promote research that not only focuses on the array of subjects medievalists now pursue in literature, theology, and philosophy, in social, political, jurisprudential, and intellectual history, the history of art, and the history of science but also that combines these subjects productively.

Adrenoceptors have been at the forefront of physiological and pharmacological research for a century.

History is littered with evidence of humanity's fascination with drugs and the pursuit of altered states.

Enrich each day with wisdom from our greatest spiritual thinkers.

There have been significant developments in the use of knowledge-based expert systems in chemistry since the first edition of this book was published in 2009.

Die Welt der Quanten ist voller atemberaubender Geschichten und Ideen – von winzigen Teilchen, die sich an zwei Orten gleichzeitig befinden, von Katzen, die lebendig und zugleich tot sind, von Quantenbomben, Raumschiffen und Teleportation.

The essential introduction to the understanding of the structure of inorganic solids and materials.

Density Functional Theory is a rapidly developing branch of many-particle physics that has found applications in atomic, molecular, solid-state and nuclear physics.