Electron correlation in molecules -- ab initio beyond Gaussian quantum chemistry

✍ Scribed by Hoggan, Philip E.; Ozdogan, Telhat

Publisher: Academic Press is an imprint of Elsevier
Year: 2016
Tongue: English
Leaves: 421
Series: Advances in Quantum Chemistry Volume 73
Edition: 1
Category: Library

No coin nor oath required. For personal study only.

✦ Synopsis

Electron Correlation in Molecules – ab initio Beyond Gaussian Quantum Chemistry presents a series of articles concerning important topics in quantum chemistry, including 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.

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
Features detailed reviews written by leading international researchers
The volume includes review on all the topics treated by world renown authors and cutting edge research contributions.

📜 SIMILAR VOLUMES

Quantum Chemistry: The Development of Ab

📁 Quantum Chemistry: The Development of Ab Initio Methods in Molecular Electronic Structure Theory

✍ Henry F. Schaefer III 📂 Library 📅 1984 🏛 Clarendon Press 🌐 English

For each of 150 landmark papers in ab initio molecular electronic structure methods, the author provides a lucid commentary. The primary focus is methodology, rather than particular chemical problems. The selected papers present important methods and illustrate their effectiveness in predicting a va

Ab Initio Methods in Quantum Chemistry

📁 Ab Initio Methods in Quantum Chemistry

✍ Kenneth P. Lawley 📂 Library 📅 1987 🏛 Wiley 🌐 English

This series aims to report, interpret and evaluate progress in the field of quantum chemistry. Over the course of several years, the series has treated the many facets of chemical physics and is designed to function as an essential reference and guide to further progress. For each volume, the editor

A New Dimension to Quantum Chemistry: An

📁 A New Dimension to Quantum Chemistry: Analytic Derivative Methods in Ab Initio Molecular Electronic Structure Theory

✍ Yukio Yamaguchi, John D. Goddard, Yoshihiro Osamura, Henry Schaefer 📂 Library 📅 1994 🏛 Oxford University Press, USA 🌐 English

In modern theoretical chemistry, the importance of the analytic evaluation of energy derivatives from reliable wave functions can hardly be overestimated. This monograph presents the formulation and implementation of analytical energy derivative methods in ab initio quantum chemistry. It includes a

Monte Carlo Methods In Ab Initio Quantum

📁 Monte Carlo Methods In Ab Initio Quantum Chemistry

✍ Bl Hammond 📂 Library 📅 1994 🏛 Wspc 🌐 English

This book presents the basic theory and application of the Monte Carlo method to the electronic structure of atoms and molecules. It assumes no previous knowledge of the subject, only a knowledge of molecular quantum mechanics at the first-year graduate level. A working knowledge of traditional ab i

AB INITIO Quantum molecular dynamics

📁 AB INITIO Quantum molecular dynamics

✍ Ben-nun M., Martinez T.J. 📂 Library 🏛 Plenum 🌐 English

Modern Methods and Algorithms of Quantum

📁 Modern Methods and Algorithms of Quantum Chemistry. ab initio Molecular Dynamics Theory

📂 Library 📅 2000 🏛 NIC 🌐 English