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Journal of the American Chemical Society
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December 7, 2013
Chemical dynamics of the first proton-coupled electron transfer of water oxidation on TiO2 anatase
Jia Chen, Ye-Fei Li, Patrick Sit, et al.
Topics in Current Chemistry
|
February 4, 2014
Electronic and optical properties of dye-sensitized TiO₂ interfaces
Mariachiara Pastore, Annabella Selloni, Simona Fantacci, et al.
The Journal of Chemical Physics
|
December 3, 2008
Excess electron states in reduced bulk anatase TiO2: comparison of standard GGA, GGA+U, and hybrid DFT calculations
Emanuele Finazzi, Cristiana Di Valentin, Gianfranco Pacchioni, et al.
Journal of the American Chemical Society
|
June 5, 2010
Simulation of electrocatalytic hydrogen production by a bioinspired catalyst anchored to a pyrite electrode
Federico Zipoli, Roberto Car, Morrel H Cohen, et al.
Chemical Science
|
June 25, 2021
Effects of applied voltage on water at a gold electrode interface from <i>ab initio</i> molecular dynamics
Zachary K Goldsmith, Marcos F Calegari Andrade, Annabella Selloni
The Journal of Chemical Physics
|
November 7, 2025
Voltage-dependent surface IR spectra of water at gold electrodes from machine-learned ab initio dipoles
Zachary K Goldsmith, Marcos F Calegari Andrade, Annabella Selloni
Journal of Chemical Theory and Computation
|
December 1, 2015
Theoretical Design by First Principles Molecular Dynamics of a Bioinspired Electrode-Catalyst System for Electrocatalytic Hydrogen Production from Acidified Water
Federico Zipoli, Roberto Car, Morrel H Cohen, et al.
Journal of Chemical Theory and Computation
|
November 19, 2015
Structural and electronic properties of photoexcited TiO2 nanoparticles from first principles
Francesca Nunzi, Saurabh Agrawal, Annabella Selloni, et al.
Accounts of Chemical Research
|
April 19, 2014
Adsorption and reactions of O2 on anatase TiO2
Ye-Fei Li, Ulrich Aschauer, Jia Chen, et al.
The Journal of Physical Chemistry Letters
|
August 21, 2015
Interaction of Oxygen and Water with the (100) Surface of Pyrite: Mechanism of Sulfur Oxidation
Patrick H-L Sit, Morrel H Cohen, Annabella Selloni
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of 14
Search research articles
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Showing results (61-70 of 137) with videos related to
Sort By:
Page
of 14
Journal of the American Chemical Society
|
December 7, 2013
Chemical dynamics of the first proton-coupled electron transfer of water oxidation on TiO2 anatase
Jia Chen, Ye-Fei Li, Patrick Sit, et al.
Topics in Current Chemistry
|
February 4, 2014
Electronic and optical properties of dye-sensitized TiO₂ interfaces
Mariachiara Pastore, Annabella Selloni, Simona Fantacci, et al.
The Journal of Chemical Physics
|
December 3, 2008
Excess electron states in reduced bulk anatase TiO2: comparison of standard GGA, GGA+U, and hybrid DFT calculations
Emanuele Finazzi, Cristiana Di Valentin, Gianfranco Pacchioni, et al.
Journal of the American Chemical Society
|
June 5, 2010
Simulation of electrocatalytic hydrogen production by a bioinspired catalyst anchored to a pyrite electrode
Federico Zipoli, Roberto Car, Morrel H Cohen, et al.
Chemical Science
|
June 25, 2021
Effects of applied voltage on water at a gold electrode interface from <i>ab initio</i> molecular dynamics
Zachary K Goldsmith, Marcos F Calegari Andrade, Annabella Selloni
The Journal of Chemical Physics
|
November 7, 2025
Voltage-dependent surface IR spectra of water at gold electrodes from machine-learned ab initio dipoles
Zachary K Goldsmith, Marcos F Calegari Andrade, Annabella Selloni
Journal of Chemical Theory and Computation
|
December 1, 2015
Theoretical Design by First Principles Molecular Dynamics of a Bioinspired Electrode-Catalyst System for Electrocatalytic Hydrogen Production from Acidified Water
Federico Zipoli, Roberto Car, Morrel H Cohen, et al.
Journal of Chemical Theory and Computation
|
November 19, 2015
Structural and electronic properties of photoexcited TiO2 nanoparticles from first principles
Francesca Nunzi, Saurabh Agrawal, Annabella Selloni, et al.
Accounts of Chemical Research
|
April 19, 2014
Adsorption and reactions of O2 on anatase TiO2
Ye-Fei Li, Ulrich Aschauer, Jia Chen, et al.
The Journal of Physical Chemistry Letters
|
August 21, 2015
Interaction of Oxygen and Water with the (100) Surface of Pyrite: Mechanism of Sulfur Oxidation
Patrick H-L Sit, Morrel H Cohen, Annabella Selloni
Page
of 14