68 citations · 70 across the 2 of their papers we have counts for
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physics.chem-ph2020★ 68 cited
Low-scaling with benchmark accuracy and application to phosphorene nanosheets
Jan Wilhelm, Patrick Seewald, Dorothea Golze
is an accurate method for computing electron addition and removal energies of molecules and solids. In a conventional implementation, however, its computational cost is $…
physics.chem-ph2020
CP2K: An Electronic Structure and Molecular Dynamics Software Package -- Quickstep: Efficient and Accurate Electronic Structure Calculations
Thomas D. Kühne, Marcella Iannuzzi, Mauro Del Ben +36
CP2K is an open source electronic structure and molecular dynamics software package to perform atomistic simulations of solid-state, liquid, molecular and biological systems. It is…