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Journal of Chemical Theory and Computation
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June 28, 2019
Fully Polarizable QM/Fluctuating Charge Approach to Two-Photon Absorption of Aqueous Solutions
Roberto Di Remigio, Tommaso Giovannini, Matteo Ambrosetti, et al.
Journal of Chemical Theory and Computation
|
August 18, 2023
Quantifying Intramolecular Basis Set Superposition Errors
Quentin Pitteloud, Peter Wind, Stig Rune Jensen, et al.
The Journal of Chemical Physics
|
April 3, 2016
A polarizable continuum model for molecules at spherical diffuse interfaces
Roberto Di Remigio, Krzysztof Mozgawa, Hui Cao, et al.
Journal of Computational Chemistry
|
December 30, 2003
New developments in the symmetry-adapted algorithm of the Polarizable Continuum Model
Luca Frediani, Roberto Cammi, Christian S Pomelli, et al.
Physical Chemistry Chemical Physics : PCCP
|
October 20, 2025
Combining the maximum overlap method with multiwavelets for core-ionisation energy calculations
Niklas Göllmann, Matthew R Ludwig, Peter Wind, et al.
The Journal of Chemical Physics
|
July 9, 2021
Multiwavelets applied to metal-ligand interactions: Energies free from basis set errors
Anders Brakestad, Peter Wind, Stig Rune Jensen, et al.
The Journal of Physical Chemistry. A
|
January 27, 2025
Noise-Tolerant Force Calculations in Density Functional Theory: A Surface Integral Approach for Wavelet-Based Methods
Moritz Gubler, Jonas A Finkler, Stig Rune Jensen, et al.
Physical Chemistry Chemical Physics : PCCP
|
March 13, 2012
A combined quantum mechanics/molecular mechanics study of the one- and two-photon absorption in the green fluorescent protein
Arnfinn Hykkerud Steindal, Jógvan Magnus Haugaard Olsen, Kenneth Ruud, et al.
Journal of Chemical Theory and Computation
|
January 1, 2024
Full Breit Hamiltonian in the Multiwavelets Framework
Christian Tantardini, Roberto Di Remigio Eikås, Magnar Bjørgve, et al.
Physical Chemistry Chemical Physics : PCCP
|
August 11, 2015
Wavelet formulation of the polarizable continuum model. II. Use of piecewise bilinear boundary elements
Monica Bugeanu, Roberto Di Remigio, Krzysztof Mozgawa, et al.
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of 5
Search research articles
Search
Showing results (21-30 of 43) with videos related to
Sort By:
Page
of 5
Journal of Chemical Theory and Computation
|
June 28, 2019
Fully Polarizable QM/Fluctuating Charge Approach to Two-Photon Absorption of Aqueous Solutions
Roberto Di Remigio, Tommaso Giovannini, Matteo Ambrosetti, et al.
Journal of Chemical Theory and Computation
|
August 18, 2023
Quantifying Intramolecular Basis Set Superposition Errors
Quentin Pitteloud, Peter Wind, Stig Rune Jensen, et al.
The Journal of Chemical Physics
|
April 3, 2016
A polarizable continuum model for molecules at spherical diffuse interfaces
Roberto Di Remigio, Krzysztof Mozgawa, Hui Cao, et al.
Journal of Computational Chemistry
|
December 30, 2003
New developments in the symmetry-adapted algorithm of the Polarizable Continuum Model
Luca Frediani, Roberto Cammi, Christian S Pomelli, et al.
Physical Chemistry Chemical Physics : PCCP
|
October 20, 2025
Combining the maximum overlap method with multiwavelets for core-ionisation energy calculations
Niklas Göllmann, Matthew R Ludwig, Peter Wind, et al.
The Journal of Chemical Physics
|
July 9, 2021
Multiwavelets applied to metal-ligand interactions: Energies free from basis set errors
Anders Brakestad, Peter Wind, Stig Rune Jensen, et al.
The Journal of Physical Chemistry. A
|
January 27, 2025
Noise-Tolerant Force Calculations in Density Functional Theory: A Surface Integral Approach for Wavelet-Based Methods
Moritz Gubler, Jonas A Finkler, Stig Rune Jensen, et al.
Physical Chemistry Chemical Physics : PCCP
|
March 13, 2012
A combined quantum mechanics/molecular mechanics study of the one- and two-photon absorption in the green fluorescent protein
Arnfinn Hykkerud Steindal, Jógvan Magnus Haugaard Olsen, Kenneth Ruud, et al.
Journal of Chemical Theory and Computation
|
January 1, 2024
Full Breit Hamiltonian in the Multiwavelets Framework
Christian Tantardini, Roberto Di Remigio Eikås, Magnar Bjørgve, et al.
Physical Chemistry Chemical Physics : PCCP
|
August 11, 2015
Wavelet formulation of the polarizable continuum model. II. Use of piecewise bilinear boundary elements
Monica Bugeanu, Roberto Di Remigio, Krzysztof Mozgawa, et al.
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of 5