241 citations · 718 across the 7 of their papers we have counts for
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cond-mat.mtrl-sci2009★ 96 cited
Resonating valence bond wave function with molecular orbitals: Application to first-row molecules
M. Marchi, S. Azadi, M. Casula +1
We introduce a method for accurate quantum chemical calculations based on a simple variational wave function, defined by a single geminal that couples all the electrons into single…
cond-mat.mtrl-sci2008★ 33 cited
Molecular hydrogen adsorbed on benzene: insights from a quantum Monte Carlo study
Todd D. Beaudet, Michele Casula, Jeongnim Kim +2
We present a quantum Monte Carlo study of the hydrogen-benzene system where binding is very weak. We demonstrate that the binding is well described at both variational Monte Carlo…