Search Results - "Kochikov, Igor V" :: K.UTB vyhledávací portál

Application of statistical criteria in the presence of systematic errors in GED

by Kochikov, Igor V., Tarasov, Yury I.
Published in Chemical physics letters (01.11.2022)

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$Equilibrium molecular structure and spectra of 6-methyl-1,5-diazabicyclo[3.1.0]hexane: joint analysis of gas phase electron diffraction, quantum chemistry, and spectroscopic data$

Equilibrium molecular structure and spectra of 6-methyl-1,5-diazabicyclo[3.1.0]hexane: joint analysis of gas phase electron diffraction, quantum chemistry, and spectroscopic data

by Khaikin, Leonid S, Ageev, Georgiy G, Rykov, Anatoliy N, Grikina, Olga E, Shishkov, Igor F, Kochikov, Igor V, Kuznetsov, Vladimir V, Makhova, Nina N, Bukalov, Sergei S, Leites, Larisa A
Published in Physical chemistry chemical physics : PCCP (15.10.2020)

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$Electron Diffraction Analysis for the Molecules with Multiple Large-Amplitude Motions. 3‑NitrostyreneA Molecule with Two Internal Rotors$

Electron Diffraction Analysis for the Molecules with Multiple Large-Amplitude Motions. 3‑NitrostyreneA Molecule with Two Internal Rotors

by Kovtun, Dmitry M, Kochikov, Igor V, Tarasov, Yury I
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (05.03.2015)

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$Equilibrium structures of the tetramezine diastereomers and their ratio: joint analysis of gas phase electron diffraction, quantum chemistry, and spectroscopic data$

Equilibrium structures of the tetramezine diastereomers and their ratio: joint analysis of gas phase electron diffraction, quantum chemistry, and spectroscopic data

by Khaikin, Leonid S, Kochikov, Igor V, Rykov, Anatoliy N, Grikina, Olga E, Ageev, Georgiy G, Shishkov, Igor F, Kuznetsov, Vladimir V, Makhova, Nina N
Published in Physical chemistry chemical physics : PCCP (06.03.2019)

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Regularized ab initio molecular force fields for key biological molecules: melatonin and pyridoxal-5′-phosphate methylamine Shiff base (Vitamin B6)

by Kuramshina, Gulnara M., Kochikov, Igor V., Sharapova, Svetlana A.
Published in Inverse problems in science and engineering (03.04.2021)

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Correlation of errors in inverse problems of optical coatings monitoring

by Kochikov, Igor V., Sharapova, Svetlana A., Yagola, Anatoly G., Tikhonravov, Alexander V.
Published in Journal of inverse and ill-posed problems (01.12.2020)

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$Equilibrium Molecular Structure of 3,3,6-trimethyl-1,5-diazabicyclo[3.1.0]hexane: the joint analysis of the gas-phase electron diffraction data and quantum chemical simulations$

Equilibrium Molecular Structure of 3,3,6-trimethyl-1,5-diazabicyclo[3.1.0]hexane: the joint analysis of the gas-phase electron diffraction data and quantum chemical simulations

by Ageev, Georgiy G., Rykov, Anatoliy N., Grikina, Olga E., Shishkov, Igor F., Kochikov, Igor V., Kuznetsov, Vladimir V., Makhova, Nina N., Bukalov, Sergei S.
Published in Structural chemistry (01.02.2022)

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$The equilibrium molecular structure of 2-cyanopyridine from combined analysis of gas-phase electron diffraction and microwave data and results of ab initio calculations$

The equilibrium molecular structure of 2-cyanopyridine from combined analysis of gas-phase electron diffraction and microwave data and results of ab initio calculations

by Vogt, Natalja, Khaikin, Leonid S., Rykov, Anatoliy N., Grikina, Olga E., Batiukov, Anatoly A., Vogt, Jürgen, Kochikov, Igor V., Shishkov, Igor F.
Published in Structural chemistry (01.10.2019)

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$Pseudo-conformer models for linear molecules: Joint treatment of spectroscopic, electron diffraction and ab initio data for the C3O2 molecule$

Pseudo-conformer models for linear molecules: Joint treatment of spectroscopic, electron diffraction and ab initio data for the C3O2 molecule

by Tarasov, Yury I., Kochikov, Igor V.
Published in Journal of molecular structure (15.06.2018)

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$Time-resolved electron diffraction and microscopy of laser-induced processes in thin films$

Time-resolved electron diffraction and microscopy of laser-induced processes in thin films

by Aseyev, Sergei A., Ryabov, Evgeny A., Mironov, Boris N., Kochikov, Igor V., Ischenko, Anatoly A.
Published in Chemical physics letters (16.06.2022)

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$Pseudo-conformer models for linear molecules: Joint treatment of spectroscopic, electron diffraction and ab initio data for the C 3 O 2 molecule$

Pseudo-conformer models for linear molecules: Joint treatment of spectroscopic, electron diffraction and ab initio data for the C 3 O 2 molecule

by Tarasov, Yury I., Kochikov, Igor V.
Published in Journal of molecular structure (01.06.2018)

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$Electron diffraction analysis for the molecules with degenerate large amplitude motions: Intramolecular dynamics in arsenic pentafluoride$

Electron diffraction analysis for the molecules with degenerate large amplitude motions: Intramolecular dynamics in arsenic pentafluoride

by Kochikov, Igor V., Kovtun, Dmitry M., Tarasov, Yury I.
Published in Journal of molecular structure (15.03.2017)

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$Internal rotation and equilibrium structure of 2-chloro-3-nitrothiophene from gas electron diffraction and quantum chemistry$

Internal rotation and equilibrium structure of 2-chloro-3-nitrothiophene from gas electron diffraction and quantum chemistry

by Kovtun, Dmitry M., Kochikov, Igor V., Tarasov, Yury I.
Published in Journal of molecular structure (15.11.2015)

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$Equilibrium structures of the tetramezine diastereomers and their ratio: joint analysis of gas phase electron diffraction, quantum chemistry, and spectroscopic dataElectronic supplementary information (ESI) available. See DOI: 10.1039/c8cp07607c$

Equilibrium structures of the tetramezine diastereomers and their ratio: joint analysis of gas phase electron diffraction, quantum chemistry, and spectroscopic dataElectronic supplementary information (ESI) available. See DOI: 10.1039/c8cp07607c

by Khaikin, Leonid S, Kochikov, Igor V, Rykov, Anatoliy N, Grikina, Olga E, Ageev, Georgiy G, Shishkov, Igor F, Kuznetsov, Vladimir V, Makhova, Nina N
Year of Publication 06.03.2019

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$The equilibrium molecular structure of 3-cyanopyridine according to gas-phase electron diffraction and microwave data and the results of quantum-chemical calculations$

The equilibrium molecular structure of 3-cyanopyridine according to gas-phase electron diffraction and microwave data and the results of quantum-chemical calculations

by Khaikin, Leonid S., Vogt, Natalja, Rykov, Anatoliy N., Grikina, Olga E., Vogt, Jürgen, Kochikov, Igor V., Ageeva, Evgeniya S., Shishkov, Igor F.
Published in Mendeleev communications (01.05.2018)

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$IR spectra of nitrobenzene and nitrobenzene-15N in the gas phase, ab initio analysis of vibrational spectra and reliable force fields of nitrobenzene and 1,3,5-trinitrobenzene. Investigation of equilibrium geometry and internal rotation in these simplest aromatic nitro compounds with one and three rotors by means of electron diffraction, spectroscopic, and quantum chemistry data$

IR spectra of nitrobenzene and nitrobenzene-15N in the gas phase, ab initio analysis of vibrational spectra and reliable force fields of nitrobenzene and 1,3,5-trinitrobenzene. Investigation of equilibrium geometry and internal rotation in these simplest aromatic nitro compounds with one and three rotors by means of electron diffraction, spectroscopic, and quantum chemistry data

by Khaikin, Leonid S., Kochikov, Igor V., Grikina, Olga E., Tikhonov, Denis S., Baskir, Esfir G.
Published in Structural chemistry (01.12.2015)

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