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On quantum Monte Carlo for the electronic structure of molecules

✍ Scribed by Brian L. Hammond; Maria M. Soto; Robert N. Barnett; William A. Lester Jr.

Book ID
113257449
Publisher
Elsevier Science
Year
1991
Tongue
English
Weight
985 KB
Volume
234
Category
Article
ISSN
0166-1280

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An overview of the development, implementation and application of quantum Monte Carlo (QMC) to electronic structure calculations of real systems such as atoms, molecules and solids is presented. The relation of QMC to traditional approaches is discussed and the basic notions of variational and diffu