# Электронная книга: Frank Jensen «Introduction to Computational Chemistry»

Introduction to Computational Chemistry 3rd Edition provides a comprehensive account of the fundamental principles underlying different computational methods. Fully revised and updated throughout to reflect important method developments and improvements since publication of the previous edition, this timely update includes the following significant revisions and new topics: * Polarizable force fields * Tight-binding DFT * More extensive DFT functionals, excited states and time dependent molecular properties * Accelerated Molecular Dynamics methods * Tensor decomposition methods * Cluster analysis * Reduced scaling and reduced prefactor methods Additional information is available at: www.wiley.com/go/jensen/computationalchemistry3 Издательство: "John Wiley&Sons Limited"
ISBN: 9781118825983 электронная книга Купить за 6857.18 руб и скачать на Litres |

## Frank Jensen

**Frank Jensen** (born

When

**References**

* [*http://www.folketinget.dk/BAGGRUND/Biografier_english/Frank_Jensen.htm# CV*] - from

Источник: Frank Jensen

### Другие книги схожей тематики:

Автор | Книга | Описание | Год | Цена | Тип книги |
---|---|---|---|---|---|

Frank Jensen | Introduction to Computational Chemistry | Introduction to Computational Chemistry 3rd Edition provides a comprehensive account of the fundamental principles underlying different computational methods. Fully revised and updated throughout to… — @John Wiley&Sons Limited, @ @ @ @ Подробнее... | 6857.18 | электронная книга | |

Kenneth Lipkowitz B. | Reviews in Computational Chemistry | The Reviews in Computational Chemistry series brings together leading authorities in the field to teach the newcomer and update the expert on topics centered on molecular modeling, such as… — @John Wiley&Sons Limited, @ @ @ @ Подробнее... | 15057.96 | электронная книга | |

Stephen Westland | Computational Colour Science Using MATLAB | Computational Colour Science Using MATLAB 2nd Edition offers a practical, problem-based approach to colour physics. The book focuses on the key issues encountered in modern colour engineering… — @John Wiley&Sons Limited, @ @ @ @ Подробнее... | 9575.15 | электронная книга | |

Kula Misra C. | Introduction to Geochemistry. Principles and Applications | This book is intended to serve as a text for an introductory course in geochemistry for undergraduate/graduate students with at least an elementary–level background in earth sciences, chemistry, and… — @John Wiley&Sons Limited, @ @ @ @ Подробнее... | 2181.42 | электронная книга | |

Matthias Dehmer | Computational Network Analysis with R. Applications in Biology, Medicine and Chemistry | This new title in the well-established«Quantitative Network Biology» series includes innovative and existing methods for analyzing network data in such areas as network biology and chemoinformatics… — @John Wiley&Sons Limited, @ @ @ @ Подробнее... | 15829.4 | электронная книга | |

James Kubicki D. | Molecular Modeling of Geochemical Reactions. An Introduction | Molecular processes in nature affect human health, the availability of resources and the Earth’s climate. Molecular modelling is a powerful and versatile toolbox that complements experimental data… — @John Wiley&Sons Limited, @ @ @ @ Подробнее... | 10424.97 | электронная книга | |

Hua-Jie Zhu | Organic Stereochemistry. Experimental and Computational Methods | Adopting a novel approach to the topic by combining theoretical knowledge and practical results, this book presents the most popular and useful computational and experimental methods applied for… — @John Wiley&Sons Limited, @ @ @ @ Подробнее... | 10549.51 | электронная книга | |

Norbert Mitzel | Structural Methods in Molecular Inorganic Chemistry | Determining the structure of molecules is a fundamental skill that all chemists must learn. Structural Methods in Molecular Inorganic Chemistry is designed to help readers interpret experimental… — @John Wiley&Sons Limited, @ @ @ @ Подробнее... | 14748.07 | электронная книга | |

Andreas Goetz W. | Electronic Structure Calculations on Graphics Processing Units. From Quantum Chemistry to Condensed Matter Physics | Electronic Structure Calculations on Graphics Processing Units: From Quantum Chemistry to Condensed Matter Physics provides an overview of computing on graphics processing units (GPUs), a brief… — @John Wiley&Sons Limited, @ @ @ @ Подробнее... | 11604.46 | электронная книга | |

Lodhi Huma M. | Elements of Computational Systems Biology | Groundbreaking, long-ranging research in this emergent field that enables solutions to complex biological problems Computational systems biology is an emerging discipline that is evolving quickly due… — @John Wiley&Sons Limited, @ @ @ @ Подробнее... | 11629.06 | электронная книга | |

Steckel Janice A | Density Functional Theory. A Practical Introduction | Demonstrates how anyone in math, science, and engineering can master DFT calculations Density functional theory (DFT) is one of the most frequently used computational tools for studying and… — @John Wiley&Sons Limited, @ @ @ @ Подробнее... | 9049.6 | электронная книга | |

Vitoriano Ruas | Numerical Methods for Partial Differential Equations. An Introduction | Numerical Methods for Partial Differential Equations: An Introduction Vitoriano Ruas, Sorbonne Universités, UPMC – Université Paris 6, France A comprehensive overview of techniques for the… — @John Wiley&Sons Limited, @ @ @ @ Подробнее... | 6593.45 | электронная книга | |

Ian Fleming | Molecular Orbitals and Organic Chemical Reactions. Reference Edition | Winner of the PROSE Award for Chemistry&Physics 2010 Acknowledging the very best in professional and scholarly publishing, the annual PROSE Awards recognise publishers'and authors'commitment to… — @John Wiley&Sons Limited, @ @ @ @ Подробнее... | 14204.63 | электронная книга | |

Snehashish Chakraverty | Fuzzy Arbitrary Order System. Fuzzy Fractional Differential Equations and Applications | Presents a systematic treatment of fuzzy fractional differential equations as well as newly developed computational methods to model uncertain physical problems Complete with comprehensive results… — @John Wiley&Sons Limited, @ @ @ @ Подробнее... | 7717.99 | электронная книга | |

Konrad Szacilowski | Infochemistry. Information Processing at the Nanoscale | Infochemistry: Information Processing at the Nanoscale, defines a new field of science, and describes the processes, systems and devices at the interface between chemistry and information sciences… — @John Wiley&Sons Limited, @ @ @ @ Подробнее... | 13736.34 | электронная книга |

### См. также в других словарях:

**Computational chemistry**— is a branch of chemistry that uses principles of computer science to assist in solving chemical problems. It uses the results of theoretical chemistry, incorporated into efficient computer programs, to calculate the structures and properties of… … Wikipedia**Chemistry education**— (or chemical education) is a comprehensive term that refers to the study of the teaching and learning of chemistry in all schools, colleges and universities. Topics in chemistry education might include understanding how students learn chemistry,… … Wikipedia**Computational particle physics**— refers to the methods and computing tools developed in and used by particle physics research. Like computational chemistry or computational biology, it is, for particle physics both a specific branch and an interdisciplinary field relying on… … Wikipedia**Computational science**— Not to be confused with computer science … Wikipedia**Chemistry**— For other uses, see Chemistry (disambiguation). Chemistry is the science of atomic matter (that made of chemical elements), its properties, structure, comp … Wikipedia**Ab initio quantum chemistry methods**— are computational chemistry methods based on quantum chemistry.[1] The term ab initio was first used in quantum chemistry by Robert Parr and coworkers, including David Craig in a semiempirical study on the excited states of benzene.[2][3] The… … Wikipedia**Basis set (chemistry)**— A basis set in chemistry is a set of functions used to create the molecular orbitals, which are expanded as a linear combination of such functions with the weights or coefficients to be determined. Usually these functions are atomic orbitals, in… … Wikipedia**Quantum chemistry composite methods**— are ab initio post Hartree Fock methods in computational chemistry that aim for high accuracy by combining the results of several calculations. They combine methods with a high level of theory and a small basis set with methods that employ lower… … Wikipedia**Cluster chemistry**— In chemistry, a cluster is an ensemble of bound atoms intermediate in size between a molecule and a bulk solid. Clusters exist of diverse stoichiometries and nuclearities. For example, carbon and boron atoms form fullerene and borane clusters,… … Wikipedia**Outline of chemistry**— The following outline is provided as an overview of and topical guide to chemistry: Chemistry – science of atomic matter (matter that is composed of chemical elements), especially its chemical reactions, but also including its properties,… … Wikipedia**Quantum chemistry**— is a branch of theoretical chemistry, which applies quantum mechanics and quantum field theory to address issues and problems in chemistry. The description of the electronic behavior of atoms and molecules as pertaining to their reactivity is one … Wikipedia