407 citations · 2.3k across the 23 of their papers we have counts for
Showing 2009 · cond-mat.mtrl-sciShow all
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cond-mat.mtrl-sci2009★ 52 cited
Unrestricted Hartree-Fock theory of Wigner crystals
J. R. Trail, M. D. Towler, R. J. Needs
We demonstrate that unrestricted Hartree-Fock theory applied to electrons in a uniform potential has stable Wigner crystal solutions for in two dimensions and $r_s…
cond-mat.mtrl-sci2009★ 79 cited
Benchmark all-electron ab initio quantum Monte Carlo calculations for small molecules
Norbert Nemec, Michael D. Towler, R. J. Needs
We study the efficiency, precision and accuracy of all-electron variational and diffusion quantum Monte Carlo calculations using Slater basis sets. Starting from wave functions gen…