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Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
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January 22, 2014
Quantum chemical determination of molecular geometries, interpretation of FT-IR, FT-Raman spectra and charge transfer properties for N-(2-cyanoethyl)-N-methylaniline
B Revathi, A Nataraj, V Balachandran
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
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May 27, 2014
Comparative thermodynamic properties, vibrational spectral studies, NBO and HOMO-LUMO analyses of 3-chloro-2,4,5,6-tetrafluoropyridine and 4-bromo-2,3,5,6-tetrafluoropyridine based on density functional theory
C Selvarani, V Balachandran, K Vishwanathan
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
February 14, 2015
Spectroscopic investigations, molecular interactions, and molecular docking studies on the potential inhibitor "thiophene-2-carboxylicacid"
T Karthick, V Balachandran, S Perumal
Nature Communications
|
January 31, 2015
Massive band gap variation in layered oxides through cation ordering
Prasanna V Balachandran, James M Rondinelli
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
March 3, 2012
Density functional theory, comparative vibrational spectroscopic studies, NBO, HOMO-LUMO analyses and thermodynamic functions of N-(bromomethyl)phthalimide and N-(chloromethyl)phthalimide
V Balachandran, S Lalitha, S Rajeswari
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
February 7, 2014
Thermal and magnetic properties and vibrational analysis of 4-(dimethylamino) pyridine: a quantum chemical approach
V Balachandran, S Rajeswari, S Lalitha
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
August 29, 2012
Rotational isomers, density functional theory, vibrational spectroscopic studies, thermodynamic functions, NBO and HOMO-LUMO analyses of 2,6-Bis(chloromethyl)pyridine
V Balachandran, S Lalitha, S Rajeswari
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
February 19, 2013
Spectroscopic (FT-IR and FT-Raman) studies, NBO, HOMO-LUMO, NMR analyses and thermodynamics functions of 5-bromo-2-methoxybenzaldehyde
V Balachandran, G Santhi, V Karpagam
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
December 31, 2013
Spectroscopic investigation of 4-nitro-3-(trifluoromethyl)aniline, NBO analysis with 4-nitro-3-(trichloromethyl)aniline and 4-nitro-3-(tribromomethyl)aniline
S Saravanan, V Balachandran, K Viswanathan
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
June 5, 2012
Vibrational spectroscopic (FT-IR and FT-Raman) studies, natural bond orbital analysis and molecular electrostatic potential surface of 3-hydroxy-6-methyl-2-nitropyridine
M Karnan, V Balachandran, M Murugan
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Search research articles
Search
Showing results (31-40 of 100) with videos related to
Sort By:
Page
of 10
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
January 22, 2014
Quantum chemical determination of molecular geometries, interpretation of FT-IR, FT-Raman spectra and charge transfer properties for N-(2-cyanoethyl)-N-methylaniline
B Revathi, A Nataraj, V Balachandran
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
May 27, 2014
Comparative thermodynamic properties, vibrational spectral studies, NBO and HOMO-LUMO analyses of 3-chloro-2,4,5,6-tetrafluoropyridine and 4-bromo-2,3,5,6-tetrafluoropyridine based on density functional theory
C Selvarani, V Balachandran, K Vishwanathan
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
February 14, 2015
Spectroscopic investigations, molecular interactions, and molecular docking studies on the potential inhibitor "thiophene-2-carboxylicacid"
T Karthick, V Balachandran, S Perumal
Nature Communications
|
January 31, 2015
Massive band gap variation in layered oxides through cation ordering
Prasanna V Balachandran, James M Rondinelli
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
March 3, 2012
Density functional theory, comparative vibrational spectroscopic studies, NBO, HOMO-LUMO analyses and thermodynamic functions of N-(bromomethyl)phthalimide and N-(chloromethyl)phthalimide
V Balachandran, S Lalitha, S Rajeswari
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
February 7, 2014
Thermal and magnetic properties and vibrational analysis of 4-(dimethylamino) pyridine: a quantum chemical approach
V Balachandran, S Rajeswari, S Lalitha
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
August 29, 2012
Rotational isomers, density functional theory, vibrational spectroscopic studies, thermodynamic functions, NBO and HOMO-LUMO analyses of 2,6-Bis(chloromethyl)pyridine
V Balachandran, S Lalitha, S Rajeswari
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
February 19, 2013
Spectroscopic (FT-IR and FT-Raman) studies, NBO, HOMO-LUMO, NMR analyses and thermodynamics functions of 5-bromo-2-methoxybenzaldehyde
V Balachandran, G Santhi, V Karpagam
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
December 31, 2013
Spectroscopic investigation of 4-nitro-3-(trifluoromethyl)aniline, NBO analysis with 4-nitro-3-(trichloromethyl)aniline and 4-nitro-3-(tribromomethyl)aniline
S Saravanan, V Balachandran, K Viswanathan
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
June 5, 2012
Vibrational spectroscopic (FT-IR and FT-Raman) studies, natural bond orbital analysis and molecular electrostatic potential surface of 3-hydroxy-6-methyl-2-nitropyridine
M Karnan, V Balachandran, M Murugan
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of 10