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Acta Crystallographica. Section B, Structural Science
|
September 22, 2009
The experimental and theoretical QTAIMC study of the atomic and molecular interactions in dinitrogen tetroxide
Vladimir G Tsirelson, Anastasia V Shishkina, Adam I Stash, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
March 26, 2021
Orbital-Free Quantum Crystallographic View on Noncovalent Bonding: Insights into Hydrogen Bonds, π⋅⋅⋅π and Reverse Electron Lone Pair⋅⋅⋅π Interactions
Sergey A Shteingolts, Adam I Stash, Vladimir G Tsirelson, et al.
Journal of the American Chemical Society
|
April 25, 2002
Characterizing the oxygen-oxygen interaction in the dinitramide anion
Elizabeth A Zhurova, Vladimir G Tsirelson, Adam I Stash, et al.
Journal of Computational Chemistry
|
July 13, 2012
Intermolecular hydrogen bond energies in crystals evaluated using electron density properties: DFT computations with periodic boundary conditions
M V Vener, A N Egorova, A V Churakov, et al.
Journal of Computational Chemistry
|
April 12, 2022
Keto-enol tautomerism from the electron delocalization perspective
Elena O Levina, Maria G Khrenova, Andrey A Astakhov, et al.
RSC Advances
|
May 2, 2022
Revealing electronic features governing hydrolysis of cephalosporins in the active site of the L1 metallo-β-lactamase
Elena O Levina, Maria G Khrenova, Andrey A Astakhov, et al.
Acta Crystallographica. Section B, Structural Science
|
July 26, 2005
Atomic interactions in ethylenebis(1-indenyl)zirconium dichloride as derived by experimental electron density analysis
Adam I Stash, Kiyoaki Tanaka, Kazunari Shiozawa, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
May 31, 2022
Real-Space Interpretation of Interatomic Charge Transfer and Electron Exchange Effects by Combining Static and Kinetic Potentials and Associated Vector Fields
Sergey A Shteingolts, Adam I Stash, Vladimir G Tsirelson, et al.
Molecules (Basel, Switzerland)
|
September 9, 2022
Can We Merge the Weak and Strong Tetrel Bonds? Electronic Features of Tetrahedral Molecules Interacted with Halide Anions
Ekaterina V Bartashevich, Svetlana E Mukhitdinova, Iliya V Klyuev, et al.
The Journal of Physical Chemistry. A
|
January 27, 2007
QTAIM study of strong H-bonds with the O-H...a fragment (A=O, N) in three-dimensional periodical crystals
M V Vener, A V Manaev, A N Egorova, et al.
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Search research articles
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Showing results (41-50 of 61) with videos related to
Sort By:
Page
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Acta Crystallographica. Section B, Structural Science
|
September 22, 2009
The experimental and theoretical QTAIMC study of the atomic and molecular interactions in dinitrogen tetroxide
Vladimir G Tsirelson, Anastasia V Shishkina, Adam I Stash, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
March 26, 2021
Orbital-Free Quantum Crystallographic View on Noncovalent Bonding: Insights into Hydrogen Bonds, π⋅⋅⋅π and Reverse Electron Lone Pair⋅⋅⋅π Interactions
Sergey A Shteingolts, Adam I Stash, Vladimir G Tsirelson, et al.
Journal of the American Chemical Society
|
April 25, 2002
Characterizing the oxygen-oxygen interaction in the dinitramide anion
Elizabeth A Zhurova, Vladimir G Tsirelson, Adam I Stash, et al.
Journal of Computational Chemistry
|
July 13, 2012
Intermolecular hydrogen bond energies in crystals evaluated using electron density properties: DFT computations with periodic boundary conditions
M V Vener, A N Egorova, A V Churakov, et al.
Journal of Computational Chemistry
|
April 12, 2022
Keto-enol tautomerism from the electron delocalization perspective
Elena O Levina, Maria G Khrenova, Andrey A Astakhov, et al.
RSC Advances
|
May 2, 2022
Revealing electronic features governing hydrolysis of cephalosporins in the active site of the L1 metallo-β-lactamase
Elena O Levina, Maria G Khrenova, Andrey A Astakhov, et al.
Acta Crystallographica. Section B, Structural Science
|
July 26, 2005
Atomic interactions in ethylenebis(1-indenyl)zirconium dichloride as derived by experimental electron density analysis
Adam I Stash, Kiyoaki Tanaka, Kazunari Shiozawa, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
May 31, 2022
Real-Space Interpretation of Interatomic Charge Transfer and Electron Exchange Effects by Combining Static and Kinetic Potentials and Associated Vector Fields
Sergey A Shteingolts, Adam I Stash, Vladimir G Tsirelson, et al.
Molecules (Basel, Switzerland)
|
September 9, 2022
Can We Merge the Weak and Strong Tetrel Bonds? Electronic Features of Tetrahedral Molecules Interacted with Halide Anions
Ekaterina V Bartashevich, Svetlana E Mukhitdinova, Iliya V Klyuev, et al.
The Journal of Physical Chemistry. A
|
January 27, 2007
QTAIM study of strong H-bonds with the O-H...a fragment (A=O, N) in three-dimensional periodical crystals
M V Vener, A V Manaev, A N Egorova, et al.
Page
of 7