A benchmark database for adsorption bond energies to transition metal surfaces and comparison to selected DFT functionals

出版年份 2015 全文链接

标题

作者

关键词

Adsorption energies, Benchmarking, Density functional theory, Catalysis, Van der Waals

出版物

Volume 640, Issue -, Pages 36-44

出版商

Elsevier BV

发表日期

2015-04-10

DOI

10.1016/j.susc.2015.03.023

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