A method for relativistic variational Mo
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Hartmut Bueckert; Stuart M. Rothstein; Jan Vrbik
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Article
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1992
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Elsevier Science
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English
โ 180 KB
We report formulas and describe how to estimate the relativistic energy and related properties of atoms and molecules by variational Monte Carlo (VMC) simulations, without having to resort to perturbation approximations. Quantities required for these simulations are routinely coupled in nonrelativis