Specialist periodical reports: Theoretical chemistry. Volume 1: Quantum chemistry (Dixon, R.N.)

Theoretical Chemistry I Quantum Mechanics

Annual Reports in Medicinal Chemistry. Volume 10

This volume is consistent with previous issues in providing annual monographs covering a wide range of topics in medicinal chemistry. Volume 10 follows a similar pattern in consisting of six major sections each edited by competent section editors: I, CNS Agents by M. Gordon; II, Pharmacodynamic Agents, by F.H. Clarke; III, Chemotherapeutic Agents by G. H. Warren; IV, Metabolic Diseases, Endocri...

2 Theoretical Organic Chemistry

Theoretical organic chemistry encompasses a wide range of topics, spanning from high level electronic structural calculations of simple organic molecules using well-established ab initio molecular orbital or density functional theory techniques to computer simulations of chemical reactions and interactions in solution. This article is divided into two sections: theoretical developments and appl...

Theoretical chemistry--quo vadis?

Theoretical concepts permeate chemistry more thoroughly than we often think. Chemists are intuitively familiar with different types of chemical bonding; with the structure, spectroscopy, and dynamics of molecules; and with the variety of different possible chemical reactions. They use theory-based concepts, for example from quantum mechanics or statistical mechanics, to describe and analyze che...

Theoretical Chemistry I

“Solange als noch für die chymischen Wirkungen der Materien aufeinander kein Begriff ausgefunden wird, der sich construieren läßt, d. i. kein Gesetz der Annäherung oder Entfernung der Theile angeben läßt, nach welchem etwa in Propertionen ihrer Dichtigkeiten u.d.g. ihre Bewegungen samt ihren Folgen sich im Raume a priori anschaulich machen und darstellen lassen (eine Forderung, die schwerlich j...