Constructing Mixed Density Functionals for Describing Dissociative Chemisorption on Metal Surfaces: Basic Principles
构建用于描述金属表面解离化学吸附的混合密度泛函:基本原理
期刊:Journal of Physical Chemistry A
影响因子:2.8
doi:10.1021/acs.jpca.3c01932
Tchakoua, Théophile; Jansen, Tim; van Nies, Youri; van den Elshout, Rebecca F A; van Boxmeer, Bart A B; Poort, Saskia P; Ackermans, Michelle G; Beltrão, Gabriel Spiller; Hildebrand, Stefan A; Beekman, Steijn E J; van der Drift, Thijs; Kaart, Sam; Šantić, Anthonie; Spuijbroek, Esmee E; Gerrits, Nick; Somers, Mark F; Kroes, Geert-Jan