Computational chemistr

Williams D E 1991. Net Atomic Charge and Multipole Models for the Ah Initio Molecula Electric Potential. In Lipkowitz K B and D B Boyd (Editors). Reviews in Computational Chemistr Volume 2. New York, VCH Publishers, pp. 219-271. 

This book is an introduction to computational chemistr y, molecular mechanics, and molecular orbital calculations, using a personal mieroeomputer. No speeial eom-putational skills are assumed of the reader aside from the ability to read and write a simple program in BASIC. No mathematieal training beyond ealeulus is assumed. A few elements of matrix algebra are introdueed in Chapter 3 and used throughout. 

Jensen. F. hirnnluclton to Computational Chemistrs. John Wile) St Sons. Inc.. New York. NY. 199. ... 

A wealth of texts, e.g. those by Clark and by Pople and coworkers, and the series Reviews in Computational Chemistr provide comprehensive overviews on the whole field of computational chemistry, in particular on quantum chemistry. The Encyclopedia of Computatioruil Chemistr, to appear in 1998, will provide a comprehensive review on state-of-the-art computational chemistry, written by world-leading experts in the field. The Intemet also provides an online forum of computational chemistry related sites, e.g. the Fourth Electronic Computational Chemistry Conteence (ECCC4) and the Journal... 

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