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Results of search for 'au:"Dutta, Bipan"'
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Authors
Banerjee, Arup
Bhattacharjee, Biplab
Chowdhury, Joydeep
De, Rina
Dutta, Bipan
Pal, Chandramadhab
Tanaka, Takeyuki
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Topics
Cyanides
Models, Molecular
Molecular Conformation
Molecular Dynamics Simulation
Nitriles
Propionates
Quantum Theory
Rotation
Spectroscopy, Fourier Transform Infrared
Spectrum Analysis, Raman
Temperature
Thermodynamics
Torsion, Mechanical
Vibration
chemistry
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English
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1.
Influence of Temperature on the Rotameric Forms of the Propyl Acetate Molecule: Raman and FTIR Spectroscopic Studies Aided by ab Initio and Car-Parrinello Molecular Dynamics Simulations.
[electronic resource]
by
Dutta, Bipan
Tanaka, Takeyuki
Chowdhury, Joydeep
Producer:
20150928
In:
The journal of physical chemistry. A
vol. 119
Online resources:
Available from publisher's website
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2.
Physics behind the Barrier to Internal Rotation of an Acetyl Chloride Molecule: A Combined Approach from Density Functional Theory, Car-Parrinello Molecular Dynamics, and Time-Resolved Wavelet Transform Theory.
[electronic resource]
by
Dutta, Bipan
Bhattacharjee, Biplab
Chowdhury, Joydeep
Publication details:
ACS omega
Jun 2018
In:
ACS omega
vol. 3
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3.
Conformational preferences of ethyl propionate molecule: Raman, temperature dependent FTIR spectroscopic study aided by ab initio quantum chemical and Car-Parrinello molecular dynamics simulation studies.
[electronic resource]
by
Dutta, Bipan
Tanaka, Takeyuki
Banerjee, Arup
Chowdhury, Joydeep
Producer:
20140110
In:
The journal of physical chemistry. A
vol. 117
Online resources:
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4.
Vibrational analysis of the conformers and understanding the genesis of the internal rotational barriers of Isobutyl Cyanide molecule.
[electronic resource]
by
Dutta, Bipan
De, Rina
Pal, Chandramadhab
Chowdhury, Joydeep
Producer:
20130418
In:
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy
vol. 96
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