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1

From molecule to solid: The prediction of organic crystal structures

A. V. Dzyabchenko

Journal:

Russian Journal of Physical Chemistry A, Focus on Chemistry

Year:

2008

Language:

english

File:

PDF, 216 KB

english, 2008

2

Phenomenology of Polymorphism, III:p,TDiagram and Stability of Piracetam Polymorphs

R. Céolin, V. Agafonov, D. Louër, V.A. Dzyabchenko, S. Toscani, J.M. Cense

Journal:

Journal of Solid State Chemistry

Year:

1996

Language:

english

File:

PDF, 601 KB

english, 1996

3

Packing Models for High-Pressure Polymeric Phases of C60

V.A. Davydov, V. Agafonov, A.V. Dzyabchenko, R. Céolin, H. Szwarc

Journal:

Journal of Solid State Chemistry

Year:

1998

Language:

english

File:

PDF, 269 KB

english, 1998

4

Prediction of structure and density for organic nitramines

A.V. Dzyabchenko, T.S. Pivina, E.A. Arnautova

Journal:

Journal of Molecular Structure

Year:

1996

Language:

english

File:

PDF, 1.04 MB

english, 1996

5

Relative stability of polymerized phases of C60: Depolymerization of a tetragonal phase

M.V. Korobov, A.G. Bogachev, A.A. Popov, V.M. Senyavin, E.B. Stukalin, A.V. Dzyabchenko, V.A. Davydov, L.S. Kashevarova, A.V. Rakhmanina, V. Agafonov

Journal:

Year:

2005

Language:

english

File:

PDF, 189 KB

english, 2005

6

Single-crystal and synchrotron X-ray powder diffraction study of the one-dimensional orthorhombic polymer phase of C60

R.J. Papoular, B.H. Toby, V.A. Davydov, A.V. Rakhmanina, A. Dzyabchenko, H. Allouchi, V. Agafonov

Journal:

Chemical Physics Letters

Year:

2008

Language:

english

File:

PDF, 935 KB

english, 2008

7

New solid solvates of C60 and C70 fullerenes: The relationship between structures and lattice energies

Mikhail V. Korobov, Evgeny B. Stukalin, Andrey L. Mirakyan, Ivan S. Neretin, Yuri L. Slovokhotov, Alexender V. Dzyabchenko, Aleksey I. Ancharov, Boris P. Tolochko

Journal:

Year:

2003

Language:

english

File:

PDF, 1.28 MB

english, 2003

8

The crystal structure of the 2D polymerized tetragonal phase of C60

B. Narymbetov, V. Agafonov, V.A. Davydov, L.S. Kashevarova, A.V. Rakhmanina, A.V. Dzyabchenko, V.I. Kulakov, Rene Ceolin

Journal:

Chemical Physics Letters

Year:

2003

Language:

english

File:

PDF, 161 KB

english, 2003

9

Conjunction of thermal lens spectrometry and high-performance liquid chromatography: Approach to data treatment

Aleksandr A. Dzyabchenko, Mikhail A. Proskurnin, Andrei G. Abroskin, Denis V. Chashchikhin

Journal:

Journal of Chromatography A

Year:

1998

Language:

english

File:

PDF, 111 KB

english, 1998

10

Theoretical structures of crystalline benzen. VI. Global search in the bisystemic structural class

A. V. Dzyabchenko

Journal:

Journal of Structural Chemistry

Year:

1987

Language:

english

File:

PDF, 660 KB

english, 1987

11

Crystal-chemical analysis of structures made up of molecules with symmetry C2

V. K. Bel'skii, A. V. Dzyabchenko

Journal:

Journal of Structural Chemistry

Year:

1975

Language:

english

File:

PDF, 261 KB

english, 1975

12

Crystal-chemical analysis of structures made up of molecules with symmetry C2

V. K. Bel'skii, A. V. Dzyabchenko

Journal:

Journal of Structural Chemistry

Year:

1975

Language:

english

File:

PDF, 306 KB

english, 1975

13

Theoretical structures of crystalline benzene. II. verification of atom-atom potentials

A. V. Dzyabchenko

Journal:

Journal of Structural Chemistry

Year:

1984

Language:

english

File:

PDF, 420 KB

english, 1984

14

Supersymmetry in the structure of 9,9-diphenyl-9,9-dihydro-9-silafluorene and the structure of 9-phenyl-9,9-dihydro-9-silafluorene

V. K. Bel'skii, A. V. Dzyabchenko

Journal:

Journal of Structural Chemistry

Year:

1985

Language:

english

File:

PDF, 419 KB

english, 1985

15

Theoretical structures of crystalline benzene: The search for a global minimum of the lattice energy in four space groups

A. V. Dzyabchenko

Journal:

Journal of Structural Chemistry

Year:

1984

Language:

english

File:

PDF, 445 KB

english, 1984

16

Theoretical structures for crystalline benzene. Part 5. Static equilibrium at negative pressures

A. V. Dzyabchenko

Journal:

Journal of Structural Chemistry

Year:

1986

Language:

english

File:

PDF, 639 KB

english, 1986

17

Theoretical structure of crystalline benzene

A. V. Dzyabchenko, M. V. Bazilevskii

Journal:

Journal of Structural Chemistry

Year:

1985

Language:

english

File:

PDF, 514 KB

english, 1985

18

Theoretical structure of crystalline benzene

A. V. Dzyabchenko, M. V. Bazilevskii

Journal:

Journal of Structural Chemistry

Year:

1985

Language:

english

File:

PDF, 539 KB

english, 1985

19

Calculation of the packing of the molecules and the determination of the crystal and molecular structure of 1,4-anthraquinone

A. V. Dzyabchenko, V. E. Zavodnik

Journal:

Journal of Structural Chemistry

Year:

1984

Language:

english

File:

PDF, 233 KB

english, 1984

20

Crycom program for approximate symmetry recognition in crystal structures

A. V. Dzyabchenko

Journal:

Journal of Structural Chemistry

Year:

1994

Language:

english

File:

PDF, 227 KB

english, 1994

21

International computer networks and new possibilities for scientific cooperation in crystallography

A. V. Dzyabchenko

Journal:

Journal of Structural Chemistry

Year:

1994

Language:

english

File:

PDF, 304 KB

english, 1994

22

Determination of copper with neocuproine by thermal-lens spectrometry

V. V. Chernysh, M. A. Proskurnin, A. A. Dzyabchenko, E. K. Ivanova

Journal:

Journal of Analytical Chemistry

Year:

2000

Language:

english

File:

PDF, 644 KB

english, 2000

23

Calculation of optimal packing and comparison of intermolecular electrostatic interaction models in C60crystals

A. V. Dzyabchenko, V. I. Shilnikov, I. A. Suslov

Journal:

Journal of Structural Chemistry

Year:

1997

Language:

english

File:

PDF, 447 KB

english, 1997

24

X-ray characterization of the triclinic polymorph of carbamazepine

Rene Ceolin, Siro Toscani, Marie-France Gardette, Viatcheslav N. Agafonov, Aleksander V. Dzyabchenko, Bernard Bachet

Journal:

Journal of Pharmaceutical Sciences

Year:

1997

Language:

english

File:

PDF, 170 KB

english, 1997

25

Identification of the polymerized orthorhombic phase of C60fullerene

V. A. Davydov, L. S. Kashevarova, A. V. Rakhmanina, A. V. Dzyabchenko, V. N. Agafonov, P. Dubois, R. Ceolin, H. Szwarc

Journal:

Year:

1997

Language:

english

File:

PDF, 60 KB

english, 1997

26

A multipole approximation of the electrostatic potential of molecules

A. V. Dzyabchenko

Journal:

Russian Journal of Physical Chemistry A, Focus on Chemistry

Year:

2008

Language:

english

File:

PDF, 155 KB

english, 2008

27

Method of enumeration of crystal superstructures based on fcc, bcc, and hexagonal close packings

A. V. Dzyabchenko, I. I. Reformatskaya

Journal:

Russian Journal of Physical Chemistry A, Focus on Chemistry

Year:

2012

Language:

english

File:

PDF, 227 KB

english, 2012

28

Polymorphism of Sulfanilamide: (II) Stability Hierarchy of α-, β- and γ- Forms from Energy Calculations by the Atom-Atom Potential Method and from the Construction of the p, T Phase Diagram

S. Toscani, A. Dzyabchenko, V. Agafonov, J. Dugué, R. Céolin

Journal:

Pharmaceutical Research

Year:

1996

File:

PDF, 670 KB

1996

29

Potential energy surface and orientational disorder in solid fullerene C60

A. V. Dzyabchenko, P. N. D'yachkov, V. N. Agafonov

Journal:

Russian Chemical Bulletin

Year:

1995

Language:

english

File:

PDF, 417 KB

english, 1995

30

Prediction of structure and density for organic nitramines

A.V. Dzyabchenko, T.S. Pivina, E.A. Arnautova

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

1996

Language:

english

File:

PDF, 1.17 MB

english, 1996

31

Tetragonal polymerized phase of C60: experimental artifact or reality?

V.A. Davydov, V. Agafonov, H. Allouchi, R. Ceolin, A.V. Dzyabchenko, H. Szwarc

Journal:

Synthetic Metals

Year:

1999

Language:

english

File:

PDF, 198 KB

english, 1999

32

A Theoretical Study of the Pressure-Induced Dimerization of C 60 Fullerene

Dzyabchenko, Alexander V., Agafonov, Viatcheslav, Davydov, Valery A.

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 101 KB

english, 1999

33

High‐Resolution X‐Ray Powder Diffraction Structure Determination of C 60 F 48

Papoular, R. J., Allouchi, H., Dzyabchenko, A. V., Davydov, V. A., Rakhmanina, A. V., Boltalina, O. V., Seppelt, K., Agafonov, V.

Journal:

Fullerenes Nanotubes and Carbon Nanostructures

Year:

2006

Language:

english

File:

PDF, 187 KB

english, 2006

34

Particularities of C 60 Transformations at 1.5 GPa

Davydov, V. A., Kashevarova, L. S., Rakhmanina, A. V., Agafonov, V., Allouchi, H., Céolin, R., Dzyabchenko, A. V., Senyavin, V. M., Szwarc, H., Tanaka, T., Komatsu, K.

Journal:

Journal of Physical Chemistry B

Year:

1999

Language:

english

File:

PDF, 94 KB

english, 1999

35

Single Crystals Synthesis and Refinement of the Crystal Structure of the Polymerized Tetragonal Phase of C 60

Davydov, V. A., Kashevarova, L. S., Rakhmanina, A. V., Narymbetov, B., Agafonov, V., Dzyabchenko, A. V., Kulakov, V. I.

Journal:

Fullerenes Nanotubes and Carbon Nanostructures

Year:

2005

Language:

english

File:

PDF, 153 KB

english, 2005

36

[IEEE Comput. Soc. Press Twenty-Eighth Annual Hawaii International Conference on System Sciences - Wailea, HI, USA (3-6 Jan. 1995)] Proceedings of the Twenty-Eighth Hawaii International Conference on System Sciences, vol.5 - Computer-aided design of crystalline drugs

Dzyabchenko, A.V., Agafonov, V.

Year:

1995

Language:

english

File:

PDF, 738 KB

english, 1995

37

Tetragonal polymerized phase of

Davydov, V. A., Kashevarova, L. S., Rakhmanina, A. V., Agafonov, V., Allouchi, H., Ceolin, R., Dzyabchenko, A. V., Senyavin, V. M., Szwarc, H.

Journal:

Physical Review B

Year:

1998

Language:

english

File:

PDF, 5.85 MB

english, 1998

38

Crystal structure predictions in assistance to experimental studies of solid-state phenomena and processes

Dzyabchenko, A.

Journal:

Acta Crystallographica Section A Foundations of Crystallography

Year:

2002

Language:

english

File:

PDF, 18 KB

english, 2002

39

The role of Zn-complex in binding of transcription factors to operator DNA: mouse EGR-1 from the Cys2His2 family

Chirgadze, Y.N., Boshkova, E.A., Polozov, R.V., Sivozhelezov, V.S., Dzyabchenko, A.V., Kuzminsky, M.B., Stepanenko, V.A., Ivanov, V.V.

Journal:

Journal of Biomolecular Structure and Dynamics

Year:

2017

Language:

english

File:

PDF, 5.15 MB

english, 2017

40

X-ray study and computational model of the solid solvate of [1,2,5]oxadiazolo[3,4-е][1,2,3,4]tetrazine 4,6-dioxide (FTDO) with benzene and ab initio crystal structure prediction of pure FTDO

Baraboshkin, Nikita М., Zelenov, Victor P., Dzyabchenko, Alexandr V., Fedyanin, Ivan V., Pivina, Tatyana S.

Journal:

Journal of Molecular Structure

Year:

2019

Language:

english

File:

PDF, 4.14 MB

english, 2019

41

X-ray study and computational model of the solid solvate of [1,2,5]oxadiazolo[3,4-е][1,2,3,4]tetrazine 4,6-dioxide (FTDO) with benzene and ab initio crystal structure prediction of pure FTDO

Baraboshkin, Nikita М., Zelenov, Victor P., Dzyabchenko, Alexandr V., Fedyanin, Ivan V., Pivina, Tatyana S.

Journal:

Journal of Molecular Structure

Year:

2019

File:

PDF, 4.14 MB

2019

42

Computer simulation of the crystal structure of tetrazino-tetrazine tetraoxide (TTTO) isomers with one and two independent molecules in the unit cell

Khakimov, D. V., Dzyabchenko, A. V., Pivina, T. S.

Journal:

Russian Chemical Bulletin

Year:

2020

File:

PDF, 288 KB

2020

43

Time for quartet: the stable 3â:â1 cocrystal formulation of FTDO and BTF â a high-energy-density material

Zelenov, Victor P., Baraboshkin, Nikita M., Khakimov, Dmitry V., Muravyev, Nikita V., Meerov, Dmitry B., Troyan, Ivan A., Pivina, Tatyana S., Dzyabchenko, Alexandr V., Fedyanin, Ivan V.

Journal:

Year:

2020

File:

PDF, 2.55 MB

2020

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