390 citations · 3.4k across the 66 of their papers we have counts for
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physics.comp-ph2017
Combining the Transcorrelated method with Full Configuration Interaction Quantum Monte Carlo: application to the homogeneous electron gas
Hongjun Luo, Ali Alavi
We suggest an efficient method to resolve electronic cusps in electronic structure calculations by using an effective transcorrelated Hamiltonian. This effective Hamiltonian takes…
physics.comp-ph2017★ 57 cited
Density matrices in full configuration interaction quantum Monte Carlo: Excited states, transition dipole moments and parallel distribution
N. S. Blunt, George H. Booth, Ali Alavi
We present developments in the calculation of reduced density matrices (RDMs) in the full configuration interaction quantum Monte Carlo (FCIQMC) method. An efficient scheme is desc…