Article ID Journal Published Year Pages File Type
5390111 Chemical Physics Letters 2006 4 Pages PDF
Abstract
Variational Monte Carlo simulation of the probability distribution function of the atomic 3d orbital. In this Letter, we have calculated the correlation energy of the ground state of the atoms Li through Kr starting from explicitly correlated wave functions by using Variational Monte Carlo.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Preview
Correlated wave functions for the ground state of the atoms Li through Kr
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