scholarly journals Study of Sulfur Isotopes by Vibrational Spectroscopy and Quantum Chemistry

2016 ◽  
Vol 8 (36) ◽  
Author(s):  
O. Kh. Poleshchuk ◽  
N. B. Egorov ◽  
D. V. Akimov ◽  
I. I. Zherin ◽  
N. A. Zhuravlev
Keyword(s):  
Quantum Chemistry ◽  
Vibrational Spectroscopy ◽  
Sulfur Isotopes

scholarly journals Study of sulfur isotopes by vibrational spectroscopy and quantum chemistry

2016 ◽  
Vol 112 ◽  
pp. 012005
Author(s):  
O Kh Poleshchuk ◽  
N B Egorov ◽  
D V Akimov ◽  
I I Zherin ◽  
N A Zhuravlev
Keyword(s):  
Quantum Chemistry ◽  
Vibrational Spectroscopy ◽  
Sulfur Isotopes

Study of the mechanism of the thermochemical reaction of polyimides with hydroxyl groups via vibrational-spectroscopy and quantum-chemistry methods

2011 ◽  
Vol 53 (9) ◽  
pp. 791-799 ◽  
Author(s):  
O. Yu. Rusakova ◽  
Yu. V. Kostina ◽  
A. S. Rodionov ◽  
G. N. Bondarenko ◽  
A. Yu. Alent’ev ◽  
...  
Keyword(s):  
Quantum Chemistry ◽  
Vibrational Spectroscopy ◽  
Hydroxyl Groups ◽  
Thermochemical Reaction

CH⋯Ni interactions and cyano-bridged heteronuclear polymeric complexes studied by vibrational spectroscopy and quantum chemistry calculations

2014 ◽  
Vol 71 ◽  
pp. 105-114 ◽  
Author(s):  
Güneş Süheyla Kürkçüoğlu ◽  
Elvan Sayın ◽  
Kansu Gör ◽  
Taner Arslan ◽  
Orhan Büyükgüngör
Keyword(s):  
Quantum Chemistry ◽  
Vibrational Spectroscopy ◽  
Quantum Chemistry Calculations ◽  
Polymeric Complexes

Unstable 1,1,2,2-Tetramethyl-1,2-disilacyclobutane and Its Polymerization. Vibrational Spectroscopy and Quantum-Chemistry Study

2012 ◽  
Vol 31 (20) ◽  
pp. 7063-7073 ◽  
Author(s):  
Vitaly G. Avakyan ◽  
Sergey S. Bukalov ◽  
Rinat R. Aysin ◽  
Larissa A. Leites
Keyword(s):  
Quantum Chemistry ◽  
Vibrational Spectroscopy

scholarly journals Tribute to Josef Michl

Chemistry ◽  
2021 ◽  
Vol 3 (1) ◽  
pp. 440-443
Author(s):  
Igor Alabugin ◽  
Petr Klán
Keyword(s):  
Quantum Chemistry ◽  
Supramolecular Chemistry ◽  
Vibrational Spectroscopy ◽  
Magnetic Circular Dichroism ◽  
Molecular Machines ◽  
80Th Birthday ◽  
Singlet Fission ◽  
Great Pleasure ◽  
Boron Chemistry ◽  
Organic Photochemistry

It is our great pleasure to introduce the Festschrift of Chemistry to honor professor Josef Michl (Figure 1) on the occasion of his 80th birthday and to recognize his exceptional contributions to the fields of organic photochemistry, quantum chemistry, biradicals and biradicaloids, electronic and vibrational spectroscopy, magnetic circular dichroism, silicon and boron chemistry, supramolecular chemistry, singlet fission, and molecular machines [...]

Photochromism of Composite Organometallic Nanostructures Based on Diarylethenes. II. Vibrational Spectroscopy and Quantum Chemistry Studies

2017 ◽  
Vol 84 (5) ◽  
pp. 770-779
Author(s):  
G. T. Vasilyuk ◽  
V. F. Askirka ◽  
A. V. Lavysh ◽  
S. A. Kurguzenkov ◽  
V. M. Yasinskii ◽  
...  
Keyword(s):  
Quantum Chemistry ◽  
Vibrational Spectroscopy

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

2019 ◽  
Vol 21 (10) ◽  
pp. 5598-5613 ◽  
Author(s):  
Leonid S. Khaikin ◽  
Igor V. Kochikov ◽  
Anatoliy N. Rykov ◽  
Olga E. Grikina ◽  
Georgiy G. Ageev ◽  
...  
Keyword(s):  
Electron Diffraction ◽  
Quantum Chemistry ◽  
Gas Phase ◽  
Vibrational Spectroscopy ◽  
Quantum Chemical ◽  
Spectroscopic Data ◽  
Joint Analysis ◽  
Equilibrium Structures ◽  
Equilibrium Geometries ◽  
Gas Phase Electron Diffraction

We applied a gas-phase electron diffraction (GED) method together with vibrational spectroscopy and quantum chemical calculations to investigate the equilibrium geometries of achiral meso and enantiomeric diastereomers of tetramezine and their ratio in the mixture.

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