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Ajay Chaudhari

Showing results (1-10 of 26) with videos related to

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Journal of Molecular Modeling|November 3, 2010
Infrared and electronic absorption spectra of n-butyronitrile and its ions using Møller Plesset methodMahadevappa Naganathappa, Ajay Chaudhari
The Journal of Physical Chemistry. A|April 21, 2011
Effect of ionization on infrared and electronic absorption spectra of methyl and ethyl formate in the gas phase and in astrophysical H2O ice: a computational studyMahadevappa Naganathappa, Ajay Chaudhari
Journal of Molecular Modeling|October 22, 2014
Theoretical investigation of hydrogen bonding interaction in H3O(+)(H2O)9 complexGul Afroz Meraj, Ajay Chaudhari
The Journal of Chemical Physics|July 23, 2004
A computational study of microsolvation effect on ethylene glycol by density functional methodAjay Chaudhari, Shyi-Long Lee
Physical Chemistry Chemical Physics : PCCP|December 6, 2016
Impact of position and number of boron atom substitution on hydrogen uptake capacity of Li-decorated pentalenePriyanka Tavhare, Amol Deshmukh, Ajay Chaudhari
Journal of Hazardous Materials|August 14, 2020
Toxic volatile organic compounds sensing by Al<sub>2</sub>C monolayer: A first-principles outlookRezvan Rahimi, Mohammad Solimannejad, Ajay Chaudhari
Physical Chemistry Chemical Physics : PCCP|December 17, 2025
Unveiling the HER potential of TM-substituted PdTe<sub>2</sub> monolayers: a first-principles studyPoonam Parkar, Ajay Chaudhari, Brahmananda Chakraborty
Journal of Computational Chemistry|January 19, 2010
Hydrogen uptake capacity of C2H4Sc and its ions: a density functional studyNitin Wadnerkar, Vijayanand Kalamse, Ajay Chaudhari
Journal of Molecular Modeling|October 13, 2011
Hydrogen storage in C3Ti complex using quantum chemical methods and molecular dynamics simulationsVijayanand Kalamse, Nitin Wadnerkar, Ajay Chaudhari
Journal of Molecular Modeling|March 7, 2012
Cooperativity effects in linear formaldehyde oligomers using density functional theory calculationsVinayak Deshmukh, Shyi-Long Lee, Ajay Chaudhari
Pageof 3

Showing results (1-10 of 26) with videos related to

Sort By:
Pageof 3
Journal of Molecular Modeling|November 3, 2010
Infrared and electronic absorption spectra of n-butyronitrile and its ions using Møller Plesset methodMahadevappa Naganathappa, Ajay Chaudhari
The Journal of Physical Chemistry. A|April 21, 2011
Effect of ionization on infrared and electronic absorption spectra of methyl and ethyl formate in the gas phase and in astrophysical H2O ice: a computational studyMahadevappa Naganathappa, Ajay Chaudhari
Journal of Molecular Modeling|October 22, 2014
Theoretical investigation of hydrogen bonding interaction in H3O(+)(H2O)9 complexGul Afroz Meraj, Ajay Chaudhari
The Journal of Chemical Physics|July 23, 2004
A computational study of microsolvation effect on ethylene glycol by density functional methodAjay Chaudhari, Shyi-Long Lee
Physical Chemistry Chemical Physics : PCCP|December 6, 2016
Impact of position and number of boron atom substitution on hydrogen uptake capacity of Li-decorated pentalenePriyanka Tavhare, Amol Deshmukh, Ajay Chaudhari
Journal of Hazardous Materials|August 14, 2020
Toxic volatile organic compounds sensing by Al<sub>2</sub>C monolayer: A first-principles outlookRezvan Rahimi, Mohammad Solimannejad, Ajay Chaudhari
Physical Chemistry Chemical Physics : PCCP|December 17, 2025
Unveiling the HER potential of TM-substituted PdTe<sub>2</sub> monolayers: a first-principles studyPoonam Parkar, Ajay Chaudhari, Brahmananda Chakraborty
Journal of Computational Chemistry|January 19, 2010
Hydrogen uptake capacity of C2H4Sc and its ions: a density functional studyNitin Wadnerkar, Vijayanand Kalamse, Ajay Chaudhari
Journal of Molecular Modeling|October 13, 2011
Hydrogen storage in C3Ti complex using quantum chemical methods and molecular dynamics simulationsVijayanand Kalamse, Nitin Wadnerkar, Ajay Chaudhari
Journal of Molecular Modeling|March 7, 2012
Cooperativity effects in linear formaldehyde oligomers using density functional theory calculationsVinayak Deshmukh, Shyi-Long Lee, Ajay Chaudhari
Pageof 3