المؤلفون: Rasmus Kronberg (3879604), Kari Laasonen (1360833)

مصطلحات موضوعية: Biophysics, Biochemistry, Sociology, Cancer, Computational Biology, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, Information Systems not elsewhere classified, energy landscapes, Computational Hydrogen Evolution Ac., hydrogen intermediates, adlayer dynamics, error cancellation, electrochemical barriers, Pt, Tafel step, rate-determining activation, equilibrium hydrogen coverages, electrochemical interface, surface saturations, energy barrier, endergonic adsorption, nontrivial treatment, Hydrogen coverage effects, entropic effects, reaction dynamics, capacitive model, hydrogen evolution activity, entropic barrier

Relation: https://figshare.com/articles/dataset/Reconciling_the_Experimental_and_Computational_Hydrogen_Evolution_Activities_of_Pt_111_through_DFT-Based_Constrained_MD_Simulations/14802920

الاتاحة: https://doi.org/10.1021/acscatal.1c00538.s002