Quantum Monte Carlo Calculations on a Benchmark Molecule - Metal Surface Reaction: H2 + Cu(111)

Author(s):
Doblhoff-Dier, K. (0000-0002-5981-9438); Meyer, J. (0000-0003-0146-730X); Hoggan, P.E.; Kroes, G.J. (0000-0002-4913-4689)
Published
2017
Publication type
Article / Letter to editor
Date issued
2017
Language
English
Is part of
Journal of Chemical Theory and Computation (2017), Vol. 13, no. 7, p. 3208-3219
hdl
1887/51420
doi
10.1021/acs.jctc.7b00344