954 citations · 2.7k across the 30 of their papers we have counts for
Showing 2020 · physics.comp-phShow all
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physics.comp-ph2020★ 38 cited
Hydration of NH in Water: Bifurcated Hydrogen Bonding Structures and Fast Rotational Dynamics
Jianqing Guo, Liying Zhou, Andrea Zen +5
Understanding the hydration and diffusion of ions in water at the molecular level is a topic of widespread importance. The ammonium ion (NH) is an exemplar system that has re…
physics.comp-ph2020★ 66 cited
TurboRVB: a many-body toolkit for {\it ab initio} electronic simulations by quantum Monte Carlo
Kousuke Nakano, Claudio Attaccalite, Matteo Barborini +9
TurboRVB is a computational package for {\it ab initio} Quantum Monte Carlo (QMC) simulations of both molecular and bulk electronic systems. The code implements two types of well e…