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The Journal of Chemical Physics
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November 26, 2008
A first principles theoretical study of vibrational spectral diffusion and hydrogen bond dynamics in aqueous ionic solutions: D2O in hydration shells of Cl(-) ions
Bhabani S Mallik, A Semparithi, Amalendu Chandra
The Journal of Physical Chemistry. A
|
September 26, 2017
Structure and Dynamics of Hydroxyl-Functionalized Protic Ammonium Carboxylate Ionic Liquids
Dhileep Nagi Reddy Thummuru, Bhabani S Mallik
The Journal of Physical Chemistry. B
|
May 27, 2020
Ionic Dynamics of Hydroxylammonium Ionic Liquids: A Classical Molecular Dynamics Simulation Study
Th Dhileep N Reddy, Bhabani S Mallik
The Journal of Physical Chemistry. B
|
September 13, 2021
Solvent-Assisted Li-Ion Transport and Structural Heterogeneity in Fluorinated Battery Electrolytes
Th Dhileep N Reddy, Bhabani S Mallik
RSC Advances
|
May 2, 2022
Nanostructure domains, voids, and low-frequency spectra in binary mixtures of <i>N</i>,<i>N</i>-dimethylacetamide and ionic liquids with varying cationic size
Th Dhileep N Reddy, Bhabani S Mallik
ACS Omega
|
August 29, 2019
Interstitial Voids and Resultant Density of Liquid Water: A First-Principles Molecular Dynamics Study
Sohag Biswas, Debashree Chakraborty, Bhabani S Mallik
The Journal of Physical Chemistry. B
|
September 24, 2019
Dynamics and Spectral Response of Water Molecules around Tetramethylammonium Cation
Aritri Biswas, Adyasa Priyadarsini, Bhabani S Mallik
The Journal of Physical Chemistry. A
|
May 22, 2008
Vibrational spectral diffusion and hydrogen bond dynamics in heavy water from first principles
Bhabani S Mallik, A Semparithi, Amalendu Chandra
Physical Chemistry Chemical Physics : PCCP
|
April 6, 2017
Protic ammonium carboxylate ionic liquids: insight into structure, dynamics and thermophysical properties by alkyl group functionalization
Th Dhileep N Reddy, Bhabani S Mallik
Physical Chemistry Chemical Physics : PCCP
|
January 28, 2020
Heterogeneity in the microstructure and dynamics of tetraalkylammonium hydroxide ionic liquids: insight from classical molecular dynamics simulations and Voronoi tessellation analysis
Th Dhileep N Reddy, Bhabani S Mallik
Page
of 14
Search research articles
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Showing results (61-70 of 136) with videos related to
Sort By:
Page
of 14
The Journal of Chemical Physics
|
November 26, 2008
A first principles theoretical study of vibrational spectral diffusion and hydrogen bond dynamics in aqueous ionic solutions: D2O in hydration shells of Cl(-) ions
Bhabani S Mallik, A Semparithi, Amalendu Chandra
The Journal of Physical Chemistry. A
|
September 26, 2017
Structure and Dynamics of Hydroxyl-Functionalized Protic Ammonium Carboxylate Ionic Liquids
Dhileep Nagi Reddy Thummuru, Bhabani S Mallik
The Journal of Physical Chemistry. B
|
May 27, 2020
Ionic Dynamics of Hydroxylammonium Ionic Liquids: A Classical Molecular Dynamics Simulation Study
Th Dhileep N Reddy, Bhabani S Mallik
The Journal of Physical Chemistry. B
|
September 13, 2021
Solvent-Assisted Li-Ion Transport and Structural Heterogeneity in Fluorinated Battery Electrolytes
Th Dhileep N Reddy, Bhabani S Mallik
RSC Advances
|
May 2, 2022
Nanostructure domains, voids, and low-frequency spectra in binary mixtures of <i>N</i>,<i>N</i>-dimethylacetamide and ionic liquids with varying cationic size
Th Dhileep N Reddy, Bhabani S Mallik
ACS Omega
|
August 29, 2019
Interstitial Voids and Resultant Density of Liquid Water: A First-Principles Molecular Dynamics Study
Sohag Biswas, Debashree Chakraborty, Bhabani S Mallik
The Journal of Physical Chemistry. B
|
September 24, 2019
Dynamics and Spectral Response of Water Molecules around Tetramethylammonium Cation
Aritri Biswas, Adyasa Priyadarsini, Bhabani S Mallik
The Journal of Physical Chemistry. A
|
May 22, 2008
Vibrational spectral diffusion and hydrogen bond dynamics in heavy water from first principles
Bhabani S Mallik, A Semparithi, Amalendu Chandra
Physical Chemistry Chemical Physics : PCCP
|
April 6, 2017
Protic ammonium carboxylate ionic liquids: insight into structure, dynamics and thermophysical properties by alkyl group functionalization
Th Dhileep N Reddy, Bhabani S Mallik
Physical Chemistry Chemical Physics : PCCP
|
January 28, 2020
Heterogeneity in the microstructure and dynamics of tetraalkylammonium hydroxide ionic liquids: insight from classical molecular dynamics simulations and Voronoi tessellation analysis
Th Dhileep N Reddy, Bhabani S Mallik
Page
of 14