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ACS Omega
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August 29, 2019
Role of Ligand Straining in Complexation of Eu<sup>3+</sup>-Am<sup>3+</sup> Ions by TPEN and PPDEN, Scalar Relativistic DFT Exploration in Conjunction with COSMO-RS
Sk Musharaf Ali
Dalton Transactions (Cambridge, England : 2003)
|
August 3, 2017
Enhanced free energy of extraction of Eu<sup>3+</sup> and Am<sup>3+</sup> ions towards diglycolamide appended calix[4]arene: insights from DFT-D3 and COSMO-RS solvation models
Sk Musharaf Ali
The Journal of Chemical Physics
|
April 22, 2006
Scaling law of shear viscosity in atomic liquid and liquid mixtures
Sk Musharaf Ali
Journal of Molecular Graphics & Modelling
|
April 16, 2026
Micro-structural analysis of aqueous uranyl ions (UO<sub>2</sub><sup>2+</sup>) during the course of forward and back extraction in A biphasic system using all atom atomistic simulations
Arya Das, Sk Musharaf Ali
The Journal of Physical Chemistry. B
|
December 27, 2023
Uniqueness of Nanoscale Confinement for Fast Water Transport: Effect of Nanotube Diameter and Hydrophobicity
Pooja Sahu, Sk Musharaf Ali
Langmuir : the ACS Journal of Surfaces and Colloids
|
June 9, 2022
Tuning Network Connectivity of Silicate and Sodium Borosilicate Glasses by TiO<sub>2</sub> for Enhanced Chemical Durability: Molecular Dynamics Simulation Investigations
Pooja Sahu, Sk Musharaf Ali
The Journal of Physical Chemistry. B
|
May 10, 2019
Molecular Dynamics Simulation Studies on Structure, Dynamics, and Thermodynamics of Uranyl Nitrate Solution at Various Acid Concentrations
Arya Das, Sk Musharaf Ali
Physical Chemistry Chemical Physics : PCCP
|
February 9, 2024
Structure and dynamics of dissociated and undissociated forms of nitric acid and their implications in interfacial mass transfer: insights from molecular dynamics simulations
Arya Das, Sk Musharaf Ali
The Journal of Chemical Physics
|
February 24, 2018
Molecular dynamics simulation for the test of calibrated OPLS-AA force field for binary liquid mixture of tri-iso-amyl phosphate and n-dodecane
Arya Das, Sk Musharaf Ali
Physical Chemistry Chemical Physics : PCCP
|
September 19, 2019
Breakdown of continuum model for water transport and desalination through ultrathin graphene nanopores: insights from molecular dynamics simulations
Pooja Sahu, Sk Musharaf Ali
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of 6
Search research articles
Search
Showing results (1-10 of 51) with videos related to
Sort By:
Page
of 6
ACS Omega
|
August 29, 2019
Role of Ligand Straining in Complexation of Eu<sup>3+</sup>-Am<sup>3+</sup> Ions by TPEN and PPDEN, Scalar Relativistic DFT Exploration in Conjunction with COSMO-RS
Sk Musharaf Ali
Dalton Transactions (Cambridge, England : 2003)
|
August 3, 2017
Enhanced free energy of extraction of Eu<sup>3+</sup> and Am<sup>3+</sup> ions towards diglycolamide appended calix[4]arene: insights from DFT-D3 and COSMO-RS solvation models
Sk Musharaf Ali
The Journal of Chemical Physics
|
April 22, 2006
Scaling law of shear viscosity in atomic liquid and liquid mixtures
Sk Musharaf Ali
Journal of Molecular Graphics & Modelling
|
April 16, 2026
Micro-structural analysis of aqueous uranyl ions (UO<sub>2</sub><sup>2+</sup>) during the course of forward and back extraction in A biphasic system using all atom atomistic simulations
Arya Das, Sk Musharaf Ali
The Journal of Physical Chemistry. B
|
December 27, 2023
Uniqueness of Nanoscale Confinement for Fast Water Transport: Effect of Nanotube Diameter and Hydrophobicity
Pooja Sahu, Sk Musharaf Ali
Langmuir : the ACS Journal of Surfaces and Colloids
|
June 9, 2022
Tuning Network Connectivity of Silicate and Sodium Borosilicate Glasses by TiO<sub>2</sub> for Enhanced Chemical Durability: Molecular Dynamics Simulation Investigations
Pooja Sahu, Sk Musharaf Ali
The Journal of Physical Chemistry. B
|
May 10, 2019
Molecular Dynamics Simulation Studies on Structure, Dynamics, and Thermodynamics of Uranyl Nitrate Solution at Various Acid Concentrations
Arya Das, Sk Musharaf Ali
Physical Chemistry Chemical Physics : PCCP
|
February 9, 2024
Structure and dynamics of dissociated and undissociated forms of nitric acid and their implications in interfacial mass transfer: insights from molecular dynamics simulations
Arya Das, Sk Musharaf Ali
The Journal of Chemical Physics
|
February 24, 2018
Molecular dynamics simulation for the test of calibrated OPLS-AA force field for binary liquid mixture of tri-iso-amyl phosphate and n-dodecane
Arya Das, Sk Musharaf Ali
Physical Chemistry Chemical Physics : PCCP
|
September 19, 2019
Breakdown of continuum model for water transport and desalination through ultrathin graphene nanopores: insights from molecular dynamics simulations
Pooja Sahu, Sk Musharaf Ali
Page
of 6