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Physical Chemistry Chemical Physics : PCCP|December 8, 2020
Designing new SRP density functionals including non-local vdW-DF2 correlation for H<sub>2</sub> + Cu(111) and their transferability to H<sub>2</sub> + Ag(111), Au(111) and Pt(111)Egidius W F Smeets, Geert-Jan Kroes
The Journal of Physical Chemistry. C, Nanomaterials and Interfaces|June 4, 2021
Performance of Made Simple Meta-GGA Functionals with rVV10 Nonlocal Correlation for H<sub>2</sub> + Cu(111), D<sub>2</sub> + Ag(111), H<sub>2</sub> + Au(111), and D<sub>2</sub> + Pt(111)Egidius W F Smeets, Geert-Jan Kroes
The Journal of Physical Chemistry. C, Nanomaterials and Interfaces|October 1, 2019
Quantum Dynamics of Dissociative Chemisorption of H<sub>2</sub> on the Stepped Cu(211) SurfaceEgidius W F Smeets, Gernot Füchsel, Geert-Jan Kroes
The Journal of Physical Chemistry. A|June 1, 2019
Specific Reaction Parameter Density Functional Based on the Meta-Generalized Gradient Approximation: Application to H<sub>2</sub> + Cu(111) and H<sub>2</sub> + Ag(111)Egidius W F Smeets, Johannes Voss, Geert-Jan Kroes
The Journal of Physical Chemistry. C, Nanomaterials and Interfaces|January 4, 2020
Correction to "Quantum Dynamics of Dissociative Chemisorption of H<sub>2</sub> on the Stepped Cu(211) Surface″Egidius W F Smeets, Gernot Füchsel, Geert-Jan Kroes
The Journal of Physical Chemistry Letters|December 9, 2020
Density Functional Theory for Molecule-Metal Surface Reactions: When Does the Generalized Gradient Approximation Get It Right, and What to Do If It Does NotNick Gerrits, Egidius W F Smeets, Stefan Vuckovic, et al.
The Journal of Physical Chemistry Letters|December 22, 2017
Anomalous Dependence of the Reactivity on the Presence of Steps: Dissociation of D<sub>2</sub> on Cu(211)Gernot Füchsel, Kun Cao, Süleyman Er, et al.
The Journal of Physical Chemistry. C, Nanomaterials and Interfaces|February 23, 2019
Transferability of the Specific Reaction Parameter Density Functional for H<sub>2</sub> + Pt(111) to H<sub>2</sub> + Pt(211)Elham Nour Ghassemi, Egidius W F Smeets, Mark F Somers, et al.
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