213 citations · 784 across the 17 of their papers we have counts for
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physics.comp-ph2013★ 71 cited
Explicitly correlated plane waves: Accelerating convergence in periodic wavefunction expansions
Andreas Grüneis, James J. Shepherd, Ali Alavi +2
We present an investigation into the use of an explicitly correlated plane wave basis for periodic wavefunction expansions at the level of second-order Møller-Plesset perturbation…
physics.comp-ph2012★ 55 cited
An explicitly correlated approach to basis set incompleteness in Full Configuration Interaction Quantum Monte Carlo
George H. Booth, Deidre Cleland, Ali Alavi +1
By performing a stochastic dynamic in a space of Slater determinants, the Full Configuration Interaction Quantum Monte Carlo (FCIQMC) method has been able to obtain energies which…