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Works cited by this work

58 works

Work: Interfacial atomic Ni tetragon intercalation in a NiO<sub>2</sub>-to-Pd hetero-structure triggers superior HER activity to the Pt catalyst

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  2. Efficient iterative schemes for<i>ab initio</i>total-energy calculations using a plane-wave basis set

    Georg Kresse, J. Furthmüller

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  3. Projector augmented-wave method

    Peter E. Blöchl

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  4. Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set

    Georg Kresse, J. Furthmüller

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    ABI

  5. A climbing image nudged elastic band method for finding saddle points and minimum energy paths

    Graeme Henkelman, Blas P. Uberuaga, Hannes Jónsson

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  6. <i>Ab initio</i>molecular dynamics for liquid metals

    Georg Kresse, J. Häfner

    Article199317 citations
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  7. A fast and robust algorithm for Bader decomposition of charge density

    Graeme Henkelman, Andri Arnaldsson, Hannes Jónsson

    Article200512 citations
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  8. Double-slit photoelectron interference in strong-field ionization of the neon dimer

    M. Kunitski, Nicolas Eicke, P. Huber +13

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  9. Electronic factors determining the reactivity of metal surfaces

    Bjørk Hammer, Jens K. Nørskov

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  10. Trends in the Exchange Current for Hydrogen Evolution

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  12. Lattice-strain control of the activity in dealloyed core–shell fuel cell catalysts

    Peter Strasser, Shirlaine Koh, Toyli Anniyev +9

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  13. Atoms in molecules : a quantum theory

    Richard F. W. Bader

    Book19906 citations
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  14. Atomic scale Pt decoration promises oxygen reduction properties of Co@Pd nanocatalysts in alkaline electrolytes for 310k redox cycles

    Yu Zhuang, Jyh‐Pin Chou, Hsin‐Yi Tiffany Chen +4

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    Andrew J. Medford, Aleksandra Vojvodić, Jens S. Hummelshøj +6

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  16. Improved tangent estimate in the nudged elastic band method for finding minimum energy paths and saddle points

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  17. Generalized gradient approximation for the exchange-correlation hole of a many-electron system

    John P. Perdew, Kieron Burke, Yue Wang

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  18. Sustainable Hydrogen Production

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  19. Theoretical surface science and catalysis—calculations and concepts

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  20. Work function-tailored graphene <i>via</i> transition metal encapsulation as a highly active and durable catalyst for the oxygen reduction reaction

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  21. Surface electronic structure and reactivity of transition and noble metals1Communication presented at the First Francqui Colloquium, Brussels, 19–20 February 1996.1

    A. V. Ruban, Bjørk Hammer, P. Stoltze +2

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  22. Thermodynamic Guidelines for the Design of Bimetallic Catalysts for Oxygen Electroreduction and Rapid Screening by Scanning Electrochemical Microscopy. M−Co (M:  Pd, Ag, Au)

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  23. Modification of the surface electronic and chemical properties of Pt(111) by subsurface 3d transition metals

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