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The Journal of Chemical Physics
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June 24, 2010
Redox potentials and pKa for benzoquinone from density functional theory based molecular dynamics
Jun Cheng, Marialore Sulpizi, Michiel Sprik
The Journal of Physical Chemistry Letters
|
April 30, 2021
Computational Amperometry of Nanoscale Capacitors in Molecular Simulations
Thomas Dufils, Michiel Sprik, Mathieu Salanne
Physical Review. E, Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics
|
November 23, 2000
Midinfrared scattering and absorption in Ge powder close to the anderson localization transition
Gomez Rivas J, Sprik, Lagendijk, et al.
The Journal of Physical Chemistry. B
|
June 15, 2006
Long-range solvent effects on the orbital interaction mechanism of water acidity enhancement in metal ion solutions: a comparative study of the electronic structure of aqueous Mg and Zn dications
Leonardo Bernasconi, Evert Jan Baerends, Michiel Sprik
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
March 8, 2012
Oxide/water interfaces: how the surface chemistry modifies interfacial water properties
Marie-Pierre Gaigeot, Michiel Sprik, Marialore Sulpizi
The Journal of Physical Chemistry Letters
|
August 21, 2015
Vibrational Sum Frequency Generation Spectroscopy of the Water Liquid-Vapor Interface from Density Functional Theory-Based Molecular Dynamics Simulations
Marialore Sulpizi, Mathieu Salanne, Michiel Sprik, et al.
The Journal of Chemical Physics
|
March 9, 2021
Band positions of anatase (001) and (101) surfaces in contact with water from density functional theory
Julian Geiger, Michiel Sprik, Matthias M May
The Journal of Physical Chemistry. B
|
February 2, 2016
Density Functional Theory Calculation of the Band Alignment of (101̅0) In(x)Ga(1-x)N/Water Interfaces
Andrew C Meng, Jun Cheng, Michiel Sprik
Journal of Chemical Theory and Computation
|
November 24, 2015
The Silica-Water Interface: How the Silanols Determine the Surface Acidity and Modulate the Water Properties
Marialore Sulpizi, Marie-Pierre Gaigeot, Michiel Sprik
Physical Chemistry Chemical Physics : PCCP
|
June 14, 2017
Effects of third-order susceptibility in sum frequency generation spectra: a molecular dynamics study in liquid water
Tatsuya Joutsuka, Tomonori Hirano, Michiel Sprik, et al.
Page
of 9
Search research articles
Search
Showing results (31-40 of 83) with videos related to
Sort By:
Page
of 9
The Journal of Chemical Physics
|
June 24, 2010
Redox potentials and pKa for benzoquinone from density functional theory based molecular dynamics
Jun Cheng, Marialore Sulpizi, Michiel Sprik
The Journal of Physical Chemistry Letters
|
April 30, 2021
Computational Amperometry of Nanoscale Capacitors in Molecular Simulations
Thomas Dufils, Michiel Sprik, Mathieu Salanne
Physical Review. E, Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics
|
November 23, 2000
Midinfrared scattering and absorption in Ge powder close to the anderson localization transition
Gomez Rivas J, Sprik, Lagendijk, et al.
The Journal of Physical Chemistry. B
|
June 15, 2006
Long-range solvent effects on the orbital interaction mechanism of water acidity enhancement in metal ion solutions: a comparative study of the electronic structure of aqueous Mg and Zn dications
Leonardo Bernasconi, Evert Jan Baerends, Michiel Sprik
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
March 8, 2012
Oxide/water interfaces: how the surface chemistry modifies interfacial water properties
Marie-Pierre Gaigeot, Michiel Sprik, Marialore Sulpizi
The Journal of Physical Chemistry Letters
|
August 21, 2015
Vibrational Sum Frequency Generation Spectroscopy of the Water Liquid-Vapor Interface from Density Functional Theory-Based Molecular Dynamics Simulations
Marialore Sulpizi, Mathieu Salanne, Michiel Sprik, et al.
The Journal of Chemical Physics
|
March 9, 2021
Band positions of anatase (001) and (101) surfaces in contact with water from density functional theory
Julian Geiger, Michiel Sprik, Matthias M May
The Journal of Physical Chemistry. B
|
February 2, 2016
Density Functional Theory Calculation of the Band Alignment of (101̅0) In(x)Ga(1-x)N/Water Interfaces
Andrew C Meng, Jun Cheng, Michiel Sprik
Journal of Chemical Theory and Computation
|
November 24, 2015
The Silica-Water Interface: How the Silanols Determine the Surface Acidity and Modulate the Water Properties
Marialore Sulpizi, Marie-Pierre Gaigeot, Michiel Sprik
Physical Chemistry Chemical Physics : PCCP
|
June 14, 2017
Effects of third-order susceptibility in sum frequency generation spectra: a molecular dynamics study in liquid water
Tatsuya Joutsuka, Tomonori Hirano, Michiel Sprik, et al.
Page
of 9