290 citations · 778 across the 14 of their papers we have counts for
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physics.chem-ph2016★ 1 cited
A Quantum Monte Carlo Study of mono(benzene)TM and bis(benzene)TM Systems
M. Chandler Bennett, Adem H. Kulahlioglu, Lubos Mitas
We present a study of mono(benzene)TM and bis(benzene)TM systems, where TM={Mo,W}. We calculate the binding energies by quantum Monte Carlo (QMC) approaches and compare the results…
physics.comp-ph2016★ 23 cited
Quantum Monte Carlo with Variable Spins
Cody A. Melton, M. Chandler Bennett, Lubos Mitas
We investigate the inclusion of variable spins in electronic structure quantum Monte Carlo, with a focus on diffusion Monte Carlo with Hamiltonians that include spin-orbit interact…