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  5. Monte Carlo Optimization of Trial Wave Functions in Quantum Mechanics and Statistical Mechanics

Monte Carlo Optimization of Trial Wave Functions in Quantum Mechanics and Statistical Mechanics

File(s)
96-263.ps (4.27 MB)
96-263.pdf (431.15 KB)
Permanent Link(s)
https://hdl.handle.net/1813/5593
Collections
Cornell Theory Center Technical Reports
Author
Nightingale, M.P.
Umrigar, C.J.
Abstract

This review covers applications of quantum Monte Carlo methods to quantum mechanical problems in the study of electronic and atomic structure, as well as applications to statistical mechanical problems both of static and dynamic nature. The common thread in all these applications is optimization of many-parameter trial states, which is done by minimization of the variance of the local energy or, more generally for arbitrary eigenvalue problems, minimization of the variance of the configurational eigenvalue.

Date Issued
1996-10
Publisher
Cornell University
Keywords
theory center
Previously Published as
http://techreports.library.cornell.edu:8081/Dienst/UI/1.0/Display/cul.tc/96-263
Type
technical report

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