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The Journal of Chemical Physics
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February 2, 2026
Performances of simplified models of cyanocobalamin for first-principles calculations
Asha Yadav, Paolo Giannozzi
Physical Review Letters
|
April 22, 1991
Structure and thermodynamics of SixGe1-x alloys from ab initio Monte Carlo simulations
de Gironcoli S, Giannozzi, Baroni
Physical Review. B, Condensed Matter
|
March 15, 1991
Ab initio calculation of phonon dispersions in semiconductors
Giannozzi, de Gironcoli S, Pavone, et al.
Physical Review. B, Condensed Matter
|
February 15, 1992
Effects of disorder on the Raman spectra of GaAs/AlAs superlattices
Molinari, Baroni, Giannozzi, et al.
Physical Review Letters
|
July 2, 1990
Phonon dispersions in GaxAl1-xAs alloys
Baroni, de Gironcoli S, Giannozzi
Physical Review. B, Condensed Matter
|
August 1, 1993
Second-order Raman spectra of diamond from ab initio phonon calculations
Windl, Pavone, Karch, et al.
Molecules (Basel, Switzerland)
|
July 19, 2021
Measuring Shared Electrons in Extended Molecular Systems: Covalent Bonds from Plane-Wave Representation of Wave Function
Giovanni La Penna, Davide Tiana, Paolo Giannozzi
Journal of Chromatography
|
October 19, 1988
Purification of specific heterologous F(ab)2 fragments with DEAE-Zeta-Prep cartridges for ion-exchange chromatography
P L Benanchi, G Gazzei, A Giannozzi
Physical Review. B, Condensed Matter
|
August 1, 1993
Ab initio lattice dynamics of diamond
Pavone, Karch, Schütt, et al.
The Journal of Chemical Physics
|
July 23, 2004
First-principle molecular dynamics with ultrasoft pseudopotentials: parallel implementation and application to extended bioinorganic systems
P Giannozzi, F De Angelis, R Car
Page
of 6
Search research articles
Search
Showing results (21-30 of 53) with videos related to
Sort By:
Page
of 6
The Journal of Chemical Physics
|
February 2, 2026
Performances of simplified models of cyanocobalamin for first-principles calculations
Asha Yadav, Paolo Giannozzi
Physical Review Letters
|
April 22, 1991
Structure and thermodynamics of SixGe1-x alloys from ab initio Monte Carlo simulations
de Gironcoli S, Giannozzi, Baroni
Physical Review. B, Condensed Matter
|
March 15, 1991
Ab initio calculation of phonon dispersions in semiconductors
Giannozzi, de Gironcoli S, Pavone, et al.
Physical Review. B, Condensed Matter
|
February 15, 1992
Effects of disorder on the Raman spectra of GaAs/AlAs superlattices
Molinari, Baroni, Giannozzi, et al.
Physical Review Letters
|
July 2, 1990
Phonon dispersions in GaxAl1-xAs alloys
Baroni, de Gironcoli S, Giannozzi
Physical Review. B, Condensed Matter
|
August 1, 1993
Second-order Raman spectra of diamond from ab initio phonon calculations
Windl, Pavone, Karch, et al.
Molecules (Basel, Switzerland)
|
July 19, 2021
Measuring Shared Electrons in Extended Molecular Systems: Covalent Bonds from Plane-Wave Representation of Wave Function
Giovanni La Penna, Davide Tiana, Paolo Giannozzi
Journal of Chromatography
|
October 19, 1988
Purification of specific heterologous F(ab)2 fragments with DEAE-Zeta-Prep cartridges for ion-exchange chromatography
P L Benanchi, G Gazzei, A Giannozzi
Physical Review. B, Condensed Matter
|
August 1, 1993
Ab initio lattice dynamics of diamond
Pavone, Karch, Schütt, et al.
The Journal of Chemical Physics
|
July 23, 2004
First-principle molecular dynamics with ultrasoft pseudopotentials: parallel implementation and application to extended bioinorganic systems
P Giannozzi, F De Angelis, R Car
Page
of 6