Шека Е.Ф.

Lecture Notes in Computer Science (including subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics). Том 2658. 2003. С. 386-403

HIGHSPIN MOLECULAR MAGNETISM OF SILICON SURFACES

Статья

Sheka E.F., Nikitina E.A., Zayets V.A.

Surface Science. Том 532-535. 2003. С. 754-758

TUNCUR: SEQUENTIAL CODES FOR SEMIEMPIRICAL QUANTUM-CHEMICAL CALCULATIONS OF TUNNELING CURRENT

Статья

Zayets V.A., Sheka E.F.

Physics of Low-Dimensional Structures. Том 11-12. 2003. С. 35-56

VIOLATION OF COVALENT BONDING IN FULLERENES

Статья

Sheka E.F.

Lecture Notes in Computer Science (including subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics). Том 2658. 2003. С. 386-403

INTERMOLECULAR INTERACTION AND VIBRATIONAL SPECTRA AT FUMED SILICA PARTICLES/SILICONE POLYMER INTERFACE

Статья

Sheka E.F.

Journal of Nanoparticle Research. Том 5. 2003. С. 419-437

NANOPACK: PARALLEL CODES FOR SEMIEMPIRICAL QUANTUM CHEMICAL CALCULATIONS OF LARGE SYSTEMS IN THE SP- AND SPD-BASIS

Статья

Berzigiyarov P.K., Zayets V.A., Ginzburg I.Ya., Razumov V.F., Sheka E.F.

International Journal of Quantum Chemistry. John Wiley and Sons Inc.. Том 88. 2002. С. 449-462

HIGH-SPIN SILICON FULLERENE SI60 AND ITS OLIGOMERS

Статья

Sheka E.F., Nikitina E.A., Zayets V.A., Ginzburg I.Ya.

International Journal of Quantum Chemistry. John Wiley and Sons Inc.. Том 88. 2002. С. 441-448

COMPARATIVE STUDY OF THE SI(100) SURFACE RECONSTRUCTION UNDER SUCCESSIVE DEHYDROGENATION. I. SI(100)(1X1)-H SURFACE

Статья

Nikitina E.A., Sheka E.F., Aono M.

Physics of Low-Dimensional Structures. Том 2001. 2001. С. 31-56

FROM SILICON FULLERENES SI-60 TO NANOFIBERS

Статья

Sheka E.F., Nikitina E.A.

Doklady Chemistry. Том 378. 2001. С. 129-134

FULLERENE MODEL OF SILICON NANOFIBERS

Статья

Sheka E.F., Nikitina E.A., Zaets V.A., Ginzburg I.Ya.

JETP Letters. Том 74. 2001. С. 177-181

INS AND IR STUDIES OF INTERMOLECULAR INTERACTION AT THE SILICONE-FUMED SILICA INTERFACE. 2. FUMED SILICA

Статья

Sheka E., Barthel H., Khavryutchenko V., Natkaniec I., Nikitina E., Weis J.

Physics of Low-Dimensional Structures. Том 2000. 2000. С. 1-24

INS STUDY OF INTERMOLECULAR INTERACTION AT THE SILICONE-FUMED SILICA INTERFACE

Статья

Sheka E., Natkaniec I., Khavryutchenko V., Nikitina E., Barthel H., Weis J.

Physica B: Condensed Matter. Elsevier Science Publishers B.V., Amsterdam. Том 276-278. 2000. С. 244-246

INS AND IR STUDIES OF INTERMOLECULAR INTERACTION AT THE SILICONE-FUMED SILICA INTERFACE. 3. ADSORPTION COMPLEXES

Статья

Sheka E., Barthel H., Khavryutchenko V., Natkaniec I., Nikitina E., Weis J.

Physics of Low-Dimensional Structures. Том 2000. 2000. С. 25-50

INS AND IR STUDIES OF INTERMOLECULAR INTERACTION AT THE SILICONE-FUMED SILICA INTERFACE I. SILICONES

Статья

Sheka E., Barthel H., Khavryutchenko V., Natkaniec I., Nikitina E., Weis J.

Physics of Low-Dimensional Structures. Том 2000. 2000. С. 127-158

SURFACE MAGNETISM OF SILICON [111](7×7) AND [001](2×1) SURFACES: QUANTUM-CHEMICAL APPROACH

Статья

Sheka E.F., Nikitina E.A., Aono M.

1999 9th International Crimean Microwave Conference: Microwave and Telecommunication Technology, CriMiCo 1999 - Conference Proceedings. Institute of Electrical and Electronics Engineers Inc.. 1999.

FUMED SILICA PARTICLES POLYDIMETHYLSILOXANE OLIGOMERS INTERFACE. 2. QUANTUM CHEMICAL MODELLING OF PARTICLE SURFACE. TETRAGONAL PACKING

Статья

Khavryutchenko V.D., Nikitina E.A., Sheka E.F., Barthel W.H., Weis J.

Physics of Low-Dimensional Structures. Том 1999. 1999. С. 1-24

INTERMOLECULAR INTERACTIONS OF POLYDIMETHYLSILOXANE OLIGOMERS WITH HYDROXYLATED AND SILYLATED FUMED SILICA

Статья

Nikitina E., Khavryutchenko V., Sheka E., Barthel H., Weis J.

Composite Interfaces. Том 6. 1999. С. 3-17

FROM MOLECULES TO PARTICLES: QUANTUM-CHEMICAL VIEW APPLIED TO FUMED SILICA

Статья

Sheka E., Khavryutchenko V., Nikitina E.

Journal of Nanoparticle Research. Том 1. 1999. С. 71-81

DEFORMATION OF POLY(DIMETHYLSILOXANE) OLIGOMERS UNDER UNIAXIAL TENSION: QUANTUM CHEMICAL VIEW

Статья

Nikitina E.A., Khavryutchenko V.D., Sheka E.F., Barthel H., Weis J.

Journal of Physical Chemistry A. American Chemical Society. Том 103. 1999. С. 11355-11365

FUMED SILICA PARTICLES/POLYDIMETHYLSILOXANE OLIGOMERS INTERFACE. I. QUANTUM-CHEMICAL MODELLING OF PARTICLE SURFACE. CUBIC PACKING

Статья

Khavryutchenko V.D., Nikitina E.A., Sheka E.F., Barthel H., Weis J.

Physics of Low-Dimensional Structures. Том 1998. 1998. С. 1-30

SUPERCLUSTER QUANTUM-CHEMICAL APPROACH TO THE SI(111)7X7 SURFACE. 2. CHARGE AND SPIN DISTRIBUTION

Статья

Khavryutchenko V., Sheka E., Huang D.H., Aono M.

Physics of Low-Dimensional Structures. Том 1998. 1998. С. 81-106

ADSORPTION MODELING OF POLYDIMETHYLSILOXANE ON SILICA: SEMIEMPIRICAL QUANTUM-CHEMICAL CALCULATIONS

Статья

Nikitina E.A., Khavryutchenko V.D., Sheka E.F., Barthel W.H., Weis J.

Surface Review and Letters. World Scientific Publishing Co. Pte Ltd. Том 4. 1997. С. 879-883

QUANTUM TECHNOLOGY APPLIED TO ALPHA-C:H FILM MODELING ASPECTS

Статья

Sheka E.F., Khavryutchenko V.D., Nikitina E.A.

Journal of Wide Bandgap Materials. Том 5. 1997. С. 298-309

TECHNOLOGICAL POLYMORPHISM OF DISPERSED AMORPHOUS SILICAS: NEUTROR INELASTIC SCATTERING ON VIBRATIONS AND COMPUTER MODELING

Статья

Sheka E.F., Markichev I.V., Natkaniec I., Khavryuchenko V.D.

Physics of Particles and Nuclei. Том 27. 1996. С. 204-233

COMPUTER MODELING OF ASSEMBLY OF ATOMS IN AN ELECTRIC FIELD

Статья

Sheka E.F., Khavryutchenko V.D., Zayetz V.A.

International Journal of Quantum Chemistry. John Wiley and Sons Inc.. Том 57. 1996. С. 741-755

COMPUTATIONAL CHEMISTRY OF THE SILICON NITRIDE SURFACE. 2. BINARY HYDROXYLAMINE COMPLEXES. GEOMETRY AND BOND ENERGIES

Статья

Goncharova N.V., Nikitina E.A., Khavryuchenko V.D., Sheka E.F.

Journal of Structural Chemistry. Том 37. 1996. С. 24-40

COMPUTATIONAL INVESTIGATION OF THE INFLUENCE OF THE ENVIRONMENT ON MECHANICAL-PROPERTIES OF SOLIDS

Статья

NIKITINA E.A., GOLUBINA T.A., MALKIN A.I., YUSHCHENKO V.S., KHAVRYUTHCENKO V.D., SHEKA E.F.

International Journal of Quantum Chemistry. John Wiley and Sons Inc.. 1995. С. 161-173

NANOMATERIALS: REALITY AND COMPUTATIONAL MODELLING

Статья

Sheka E.F., Khavryutchenko V.D.

Nanostructured Materials. Elsevier Ltd. Том 6. 1995. С. 803-806

TECHNOLOGICAL POLYMORPHISM OF DISPERSE AMORPHOUS SILICAS - INELASTIC NEUTRON-SCATTERING AND COMPUTATIONAL MODELING

Статья

SHEKA E.F., KHAVRYUCHENKO V.D., MARKICHEV I.V.

Uspekhi Khimii. Том 64. 1995. С. 419-445

FORMATION OF NANOSTRUCTURES ON AN ALPHA-C:H FILM IN THE PRESENCE OF AN ADSORBATE

Статья

Luskinovich P.N., Frolov V.D., Shavykin A.E., Khavryuchenko V.D., Sheka E.F., Nikitina E.A.

JETP Letters. Том 62. 1995. С. 881-886

COMPUTATIONAL INVESTIGATION OF THE INFLUENCE OF THE ENVIRONMENT ON MECHANICAL PROPERTIES OF SOLIDS

Статья

Nikitina E.A., Golubina T.A., Malkin A.I., Yushchenko V.S., Khavryuthcenko V.D., Sheka E.F.

International Journal of Quantum Chemistry. John Wiley and Sons Inc.. Том 56. 1995. С. 161-173

TECHONOLOGICAL POLYMORPHISM OF DISPERSE AMORPHOUS SILICAS: INELASTIC NEUTRON SCATTERING AND COMPUTER MODELLING

Статья

Sheka E.F., Khavryuchenko V.D., Markichev I.V.

Russian Chemical Reviews. Том 64. 1995. С. 389-414

COMPUTATIONAL CHEMISTRY OF THE SILICON-NITRIDE SURFACE .1. WATER, AMMONIA, AND WATER-AMMONIA COMPLEX

Статья

GONCHAROVA N.V., NIKITINA E.A., KHAVRYUCHENKO V.D., SHEKA E.F.

Journal of Structural Chemistry. Том 36. 1995. С. 50-59

COMPUTATIONAL MODELING OF AMORPHOUS SILICA .4. MODELING THE INITIAL STRUCTURES - AEROGEL

Статья

KHAVRYUCHENKO V.D., SHEKA E.F.

Journal of Structural Chemistry. Том 35. 1994. С. 305-308

DENSITY OF VIBRATIONAL STATES OF THIOL CAPPED CDS PARTICLES. INELASTIC NEUTRON SCATTERING

Статья

Markichev I., Sheka E., Natkaniec I., Muzychka A., Khavryutchenko V., Wang Y., Herron N.

Physica B: Condensed Matter. Elsevier Science Publishers B.V., Amsterdam. Том 198. 1994. С. 197-199

DENSITY OF VIBRATIONAL STATES OF SILICON NITRIDE

Статья

Markichev I., Sheka E., Goncharova N., Natkaniec I., Muzychka A., Chukalin V., Khavryutchenko V., Nikitina E.

Physica B: Condensed Matter. Elsevier Science Publishers B.V., Amsterdam. Том 198. 1994. С. 200-202

COMPUTATIONAL MODELING OF AMORPHOUS SILICA .2. MODELING THE INITIAL STRUCTURES - AEROSIL

Статья

KHAVRYUCHENKO V.D., SHEKA E.F.

Journal of Structural Chemistry. Том 35. 1994. С. 291-298

SURFACE VIBRATIONS OF SILICON NITRIDE: INELASTIC NEUTRON SCATTERING STUDY AND COMPUTER MODELING

Статья

Sheka E., Khavryutchenko V., Nikitina E., Natkaniec I., Markichev I., Goncharova N., Chukalin V.

Journal of Electron Spectroscopy and Related Phenomena. Том 67. 1994. С. 133-139

COMPUTATIONAL MODELING OF AMORPHOUS SILICA .3. MODELING THE INITIAL STRUCTURES - SILICA-GEL

Статья

KHAVRYUCHENKO V.D., SHEKA E.F.

Journal of Structural Chemistry. Том 35. 1994. С. 299-304

OSCILLATING SPECTROSCOPY OF DISPERSE SILICA - NONELASTIC SCATTERING OF NEUTRONS

Статья

SHEKA E.F., NATKANETS I., KHAVRYUCHENKO V.D., NECHITAILOV P.B., MARKICHEV I.V., MUZYCHKA A.Y.

ЖУРНАЛ ФИЗИЧЕСКОЙ ХИМИИ. MEZHDUNARODNAYA KNIGA / Федеральное государственное бюджетное учреждение "Российская академия наук". Том 67. 1993. С. 38-47

CONSTRUCTION OF VIBRATIONAL BASIS SPECTRA OF MULTICOMPONENT SYSTEMS .1. AEROSIL

Статья

MARKICHEV I.V., NATKANETS I., SHEKA E.F.

Journal of Structural Chemistry. Том 34. 1993. С. 46-55

VIBRATIONS OF DISPERSE SILICAS - A COMPARATIVE-STUDY

Статья

SHEKA E.F., NATKANIEC I., MARKICHEV I.V., KHAVRYUTCHENKO V.D.

PHONON SCATTERING IN CONDENSED MATTER VII: PROCEEDINGS OF THE SEVENTH INTERNATIONAL CONFERENCE. SPRINGER-VERLAG BERLIN. Том 112. 1993. С. 303-305

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