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pro vyhledávání: '"S. J. Binnie"'
Autor:
Dario Alfè, Frederick R. Manby, S. J. Nolan, S. J. Binnie, Neil L. Allan, Neil Drummond, M. J. Gillan
We show how accurate benchmark values of the surface formation energy of crystalline lithium hydride can be computed by the complementary techniques of quantum Monte Carlo (QMC) and wave-function-based molecular quantum chemistry. To demonstrate the
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::39c32a900268a6564a2b5c0c87ea242a
https://doi.org/10.1103/PhysRevB.82.165431
https://doi.org/10.1103/PhysRevB.82.165431
