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X
Tsirelson, Vladimir G.
132  Ergebnisse:
Personensuche X
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1

Silatranes and germatranes as the systems with intramolecul..:

Bartashevich, Ekaterina V. ; Regel, Roman L. ; Tsirelson, Vladimir G.
Theoretical Chemistry Accounts.  143 (2024)  5 - p. , 2024
Link: https://doi.org/10.1007/..
 
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2

Electronic and Crystal Packing Effects in Terms of Static a..:

Kartashov, Sergey V. ; Shteingolts, Sergey A. ; Stash, Adam I...
Crystal Growth & Design.  23 (2023)  3 - p. 1726-1742 , 2023
Link: https://doi.org/10.1021/..
 
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3

Negative Linear Compressibility of Formate Crystals from th..:

Matveychuk, Yury V. ; Sobalev, Sergey A. ; Borisova, Polina I...
Crystals.  13 (2023)  7 - p. 1147 , 2023
Link: https://doi.org/10.3390/..
 
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4

DFT potentials from a chemical perspective: Anatomy of elec..:

Levina, Elena O. ; Tsirelson, Vladimir G.
Journal of Computational Chemistry.  44 (2023)  22 - p. 1817-1835 , 2023
Link: https://doi.org/10.1002/..
 
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5

Unified Picture of Interatomic Interactions, Structures, an..:

Saifina, Alina F. ; Kartashov, Sergey V. ; Stash, Adam I...
Crystal Growth & Design.  23 (2023)  4 - p. 3002-3018 , 2023
Link: https://doi.org/10.1021/..
 
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6

Electron delocalization in defect-containing graphene and i..:

Bartashevich, Ekaterina V. ; Levina, Elena O. ; Yushina, Irina D...
Physical Chemistry Chemical Physics.  25 (2023)  36 - p. 24342-24354 , 2023
Link: https://doi.org/10.1039/..
 
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7

How electron delocalization influences the electron-withdra..:

Levina, Elena O. ; Bartashevich, Ekaterina V. ; Batalov, Alexey E...
Mendeleev Communications.  33 (2023)  3 - p. 372-375 , 2023
Link: https://doi.org/10.1016/..
 
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8

Keto‐enol tautomerism from the electron delocalization pers..:

Levina, Elena O. ; Khrenova, Maria G. ; Astakhov, Andrey A..
Journal of Computational Chemistry.  43 (2022)  15 - p. 1000-1010 , 2022
Link: https://doi.org/10.1002/..
 
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9

State-of-the-art of computational green chemistry in leadin..:

, In: Green Chemistry and Computational Chemistry,
Khrenova, Maria G. ; Tsirelson, Vladimir G. ; Lokteva, Ekaterina S.. - p. 55-77 , 2022
Link: https://doi.org/10.1016/..
 
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10

Contributors:

, In: Green Chemistry and Computational Chemistry,
Alimi, Kamel ; Amovilli, Claudio ; Antonio, Felipe C.T.... - p. xiii-xvii , 2022
Link: https://doi.org/10.1016/..
 
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11

Can We Merge the Weak and Strong Tetrel Bonds? Electronic F..:

Bartashevich, Ekaterina V. ; Mukhitdinova, Svetlana E. ; Klyuev, Iliya V..
Molecules.  27 (2022)  17 - p. 5411 , 2022
Link: https://doi.org/10.3390/..
 
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12

Real‐Space Interpretation of Interatomic Charge Transfer an..:

Shteingolts, Sergey A. ; Stash, Adam I. ; Tsirelson, Vladimir G..
Chemistry – A European Journal.  28 (2022)  48 - p. , 2022
Link: https://doi.org/10.1002/..
 
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13

The explicit role of electron exchange in the hydrogen bond..:

Levina, Elena O. ; Khrenova, Maria G. ; Tsirelson, Vladimir G.
Journal of Computational Chemistry.  42 (2021)  12 - p. 870-882 , 2021
Link: https://doi.org/10.1002/..
 
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14

Orbital‐Free Quantum Crystallographic View on Noncovalent B..:

Shteingolts, Sergey A. ; Stash, Adam I. ; Tsirelson, Vladimir G..
Chemistry – A European Journal.  27 (2021)  28 - p. 7789-7809 , 2021
Link: https://doi.org/10.1002/..
 
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15

Bond orders and electron delocalization indices for S–N, S–..:

Bartashevich, Ekaterina V. ; Mukhitdinova, Svetlana E. ; Tsirelson, Vladimir G.
Mendeleev Communications.  31 (2021)  5 - p. 680-683 , 2021
Link: https://doi.org/10.1016/..
 
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