June 16, 2004 article Open access Van der Waals Density Functional for General Geometries Physical Review Letters DOI: 10.1103/physrevlett.92.246401 Full text (OA) OpenAlex Authors 0 Author list not loaded yet. Cited by 17 stored of 5,673 Search Sort Most cited Newest Oldest Patent citations Title Any typearticle review book-chapter conference-paper preprint dissertation book dataset other Any fieldAgricultural and Biological Sciences Arts and Humanities Biochemistry, Genetics and Molecular Biology Business, Management and Accounting Chemical Engineering Chemistry Computer Science Decision Sciences Dentistry Earth and Planetary Sciences Economics, Econometrics and Finance Energy Engineering Environmental Science Health Professions Immunology and Microbiology Materials Science Mathematics Medicine Neuroscience Nursing Pharmacology, Toxicology and Pharmaceutics Physics and Astronomy Psychology Social Sciences Veterinary Open access Limits of BOSS DFT: O2 + Al(111) Dynamics on a Screened Hybrid Van der Waals DFT Potential Energy Surface 2025 The Journal of Physical Chemistry C article Physics and Astronomy Advanced Chemical Physics Studies Open access 2 citations Best-of-both-worlds computational approaches to difficult-to-model dissociation reactions on metal surfaces 2024 Chemical Science article Physics and Astronomy Advanced Chemical Physics Studies Open access 15 citations O2 Dissociation on Cu(111) Dynamics on a Novel Screened Hybrid van der Waals DFT Potential Energy Surface 2024 The Journal of Physical Chemistry C article Physics and Astronomy Advanced Chemical Physics Studies Open access 3 citations How to simulate dissociative chemisorption of methane on metal surfaces 2024 Frontiers in Chemistry article Physics and Astronomy Advanced Chemical Physics Studies Open access 1 citations Reaction barriers at metal surfaces computed using the random phase approximation: Can we beat DFT in the generalized gradient approximation? 2024 The Journal of Chemical Physics article Physics and Astronomy Advanced Chemical Physics Studies Open access 16 citations Constructing Mixed Density Functionals for Describing Dissociative Chemisorption on Metal Surfaces: Basic Principles 2023 The Journal of Physical Chemistry A article Physics and Astronomy Advanced Chemical Physics Studies Open access 9 citations SBH17: Benchmark Database of Barrier Heights for Dissociative Chemisorption on Transition Metal Surfaces 2022 Journal of Chemical Theory and Computation article Physics and Astronomy Advanced Chemical Physics Studies Open access 39 citations Assessing density functionals for describing methane dissociative chemisorption on Pt(110)-(2×1) surface 2021 Chinese Journal of Chemical Physics article Physics and Astronomy Advanced Chemical Physics Studies Open access 6 citations Performance of Made Simple Meta-GGA Functionals with rVV10 Nonlocal Correlation for H 2 + Cu(111), D 2 + Ag(111), H 2 + Au(111), and D 2 + Pt(111) 2021 The Journal of Physical Chemistry C article Physics and Astronomy Advanced Chemical Physics Studies Open access 23 citations Interaction of Aromatic Molecules with Forsterite: Accuracy of the Periodic DFT-D4 Method 2021 The Journal of Physical Chemistry A article Physics and Astronomy Advanced Chemical Physics Studies Open access 13 citations Moiré metrology of energy landscapes in van der Waals heterostructures 2021 Nature Communications article Materials Science 2D Materials and Applications Open access 97 citations Moiré metrology of energy landscapes in van der Waals heterostructures 2021 RWTH Publications (RWTH Aachen) article Materials Science 2D Materials and Applications Open access 83 citations Computational approaches to dissociative chemisorption on metals: towards chemical accuracy 2021 Physical Chemistry Chemical Physics article Physics and Astronomy Advanced Chemical Physics Studies Open access 96 citations Quantum Monte Carlo calculations on dissociative chemisorption of H2 + Al(110): Minimum barrier heights and their comparison to DFT values 2020 The Journal of Chemical Physics article Physics and Astronomy Advanced Chemical Physics Studies Open access 26 citations Designing new SRP density functionals including non-local vdW-DF2 correlation for H 2 + Cu(111) and their transferability to H 2 + Ag(111), Au(111) and Pt(111) 2020 Physical Chemistry Chemical Physics article Physics and Astronomy Advanced Chemical Physics Studies Open access 18 citations Closing the Gap Between Experiment and Theory: Reactive Scattering of HCl from Au(111) 2020 The Journal of Physical Chemistry C article Physics and Astronomy Advanced Chemical Physics Studies Open access 39 citations A Semiempirical Method to Detect and Correct DFT-Based Gas-Phase Errors and Its Application in Electrocatalysis 2020 ACS Catalysis article Physics and Astronomy Advanced Chemical Physics Studies Open access 135 citations 17 results References 0