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The Journal of Physical Chemistry. A
|
July 14, 2009
Binding entropy and its application to solids
Vladimir G Tsirelson, Agnes Nagy
Acta Crystallographica. Section B, Structural Science
|
May 4, 2000
Electron density of KNiF3: analysis of the atomic interactions
Tsirelson, Ivanov, Zhurova, et al.
Physical Chemistry Chemical Physics : PCCP
|
January 17, 2013
Atomic dipole polarization in charge-transfer complexes with halogen bonding
E V Bartashevich, V G Tsirelson
Journal of Computational Chemistry
|
June 30, 2025
Unveiling Hidden Intramolecular Non-Covalent Interactions in a Neutral Serine, Its Zwitterion, Cluster, and Crystal by Features of Electron Density
Vasilii Korotenko, Anna Egorova, Vladimir Tsirelson
Acta Crystallographica. Section B, Structural Science
|
August 1, 2002
Electron density and energy density view on the atomic interactions in SrTiO3
Elizabeth A Zhurova, Vladimir G Tsirelson
Molecules (Basel, Switzerland)
|
March 22, 2019
Identification of the Tetrel Bonds between Halide Anions and Carbon Atom of Methyl Groups Using Electronic Criterion
Ekaterina Bartashevich, Yury Matveychuk, Vladimir Tsirelson
Journal of Computational Chemistry
|
May 15, 2023
DFT potentials from a chemical perspective: Anatomy of electron (de)localization in molecules and crystals
Elena O Levina, Vladimir G Tsirelson
Journal of Chemical Theory and Computation
|
March 26, 2025
Going beyond the Computational Tool: Fermi Potential from DFT as an Electron (De)Localization Descriptor for Correlated Wave Functions
Elena O Levina, Vladimir G Tsirelson
Acta Crystallographica. Section B, Structural Science
|
August 6, 2000
Electron density study of urea using TDS-corrected X-ray diffraction data: quantitative comparison of experimental and theoretical results
Zavodnik, Stash, Tsirelson, et al.
Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials
|
March 25, 2025
Electron density and elastic properties of crystalline [Co(NH<sub>3</sub>)<sub>5</sub>NO<sub>2</sub>]ClNO<sub>3</sub>: a quantum crystallography study
Mark Khainovsky, Ekaterina Terekhova, Elena Boldyreva, et al.
Page
of 7
Search research articles
Search
Showing results (11-20 of 61) with videos related to
Sort By:
Page
of 7
The Journal of Physical Chemistry. A
|
July 14, 2009
Binding entropy and its application to solids
Vladimir G Tsirelson, Agnes Nagy
Acta Crystallographica. Section B, Structural Science
|
May 4, 2000
Electron density of KNiF3: analysis of the atomic interactions
Tsirelson, Ivanov, Zhurova, et al.
Physical Chemistry Chemical Physics : PCCP
|
January 17, 2013
Atomic dipole polarization in charge-transfer complexes with halogen bonding
E V Bartashevich, V G Tsirelson
Journal of Computational Chemistry
|
June 30, 2025
Unveiling Hidden Intramolecular Non-Covalent Interactions in a Neutral Serine, Its Zwitterion, Cluster, and Crystal by Features of Electron Density
Vasilii Korotenko, Anna Egorova, Vladimir Tsirelson
Acta Crystallographica. Section B, Structural Science
|
August 1, 2002
Electron density and energy density view on the atomic interactions in SrTiO3
Elizabeth A Zhurova, Vladimir G Tsirelson
Molecules (Basel, Switzerland)
|
March 22, 2019
Identification of the Tetrel Bonds between Halide Anions and Carbon Atom of Methyl Groups Using Electronic Criterion
Ekaterina Bartashevich, Yury Matveychuk, Vladimir Tsirelson
Journal of Computational Chemistry
|
May 15, 2023
DFT potentials from a chemical perspective: Anatomy of electron (de)localization in molecules and crystals
Elena O Levina, Vladimir G Tsirelson
Journal of Chemical Theory and Computation
|
March 26, 2025
Going beyond the Computational Tool: Fermi Potential from DFT as an Electron (De)Localization Descriptor for Correlated Wave Functions
Elena O Levina, Vladimir G Tsirelson
Acta Crystallographica. Section B, Structural Science
|
August 6, 2000
Electron density study of urea using TDS-corrected X-ray diffraction data: quantitative comparison of experimental and theoretical results
Zavodnik, Stash, Tsirelson, et al.
Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials
|
March 25, 2025
Electron density and elastic properties of crystalline [Co(NH<sub>3</sub>)<sub>5</sub>NO<sub>2</sub>]ClNO<sub>3</sub>: a quantum crystallography study
Mark Khainovsky, Ekaterina Terekhova, Elena Boldyreva, et al.
Page
of 7