55 citations · 55 across the 1 of their papers we have counts for
2 papers
cond-mat.str-el2017★ 55 cited
Computation of ground-state properties in molecular systems: back-propagation with auxiliary-field quantum Monte Carlo
Mario Motta, Shiwei Zhang
We address the computation of ground-state properties of chemical systems and realistic materials within the auxiliary-field quantum Monte Carlo method. The phase constraint to con…
physics.comp-ph2017
Towards the solution of the many-electron problem in real materials: equation of state of the hydrogen chain with state-of-the-art many-body methods
Mario Motta, David M. Ceperley, Garnet Kin-Lic Chan +18
We present numerical results for the equation of state of an infinite chain of hydrogen atoms. A variety of modern many-body methods are employed, with exhaustive cross-checks and…