464 citations
Counting papers with at most 25 authors, so collaboration author lists do not stand in for the people here.
- California Institute of TechnologyUS15 papers
- Lawrence Berkeley National LaboratoryUS9 papers
- Rensselaer Polytechnic InstituteUS5 papers
- Kavli Nanoscience InstituteUS4 papers
- University of California, BerkeleyUS4 papers
- Helmholtz-Zentrum Berlin für Materialien und EnergieDE3 papers
- Technische Universität IlmenauDE3 papers
- Argonne National LaboratoryUS2 papers
- Cornell UniversityUS2 papers
- Fraunhofer Institute for Solar Energy SystemsDE2 papers
- Friedrich Schiller University JenaDE2 papers
- Fritz Haber Institute of the Max Planck SocietyDE2 papers
5 papers · 1 filter
The spatial collection efficiency of photogenerated charge carriers in photovoltaic and photoelectrochemical devices
Gideon Segev, Hen Dotan, David S. Ellis +7
The spatial collection efficiency portrays the driving forces and loss mechanisms in photovoltaic and photoelectrochemical devices. It is defined as the fraction of photogenerated…
Reaction Mechanism of the Selective Reduction of CO to CO by a Tetraaza [CoNH] Complex in the Presence of Protons
Alejandro J. Garza, Srimanta Pakhira, Alexis T. Bell +2
The tetraaza [CoNH] complex (\textbf{1}) is remarkable for its ability to selectively reduce CO to CO with 45\% Faradaic efficiency and a CO to H rat…
Grand canonical electronic density-functional theory: algorithms and applications to electrochemistry
Ravishankar Sundararaman, William A. Goddard, Tomas A. Arias
First-principles calculations combining density-functional theory and continuum solvation models enable realistic theoretical modeling and design of electrochemical systems. When a…
Partial oxidation of Step-Bound Water Leads to Anomalous pH Effects on Metal Electrode Step-Edges
Kathleen Schwarz, Bingjun Xu, Yushan Yan +1
The design of better heterogeneous catalysts for applications such as fuel cells and electrolyzers requires a mechanistic understanding of electrocatalytic reactions and the depend…
The charge-asymmetric nonlocally-determined local-electric (CANDLE) solvation model
Ravishankar Sundararaman, William A. Goddard
Many important applications of electronic structure methods involve molecules or solid surfaces in a solvent medium. Since explicit treatment of the solvent in such methods is usua…