Articles

type: Conference
Title Date
Molecular dynamics simulation of 13C NMR powder lineshapes of linear molecules in structure I clathrate hydrate
Molecular dynamics simulation study of self-diffusivity of carbon disulfide gas in ITQ-7 zeolite
Study of self-diffusion of methane and carbon dioxide in BEA zeolite with MD simulation
Comparison of the diffusion of CO and N2 in ITQ-7 zeolite via Molecular dynamics simulation
Molecular Dynamics Simulation of Dynamics and Diffusion Coefficients of Tetrabutylphosphonium Amino Acid Based room temperature Ionic Liquids
Molecular Dynamics studies of the Electrical Conductivity of Imidazolium-Based Ionic liquids
Molecular Dynamics Simulation of the Amino Acid Ionic Liquids with the Alanine and Glycine Anions
Atomistic Simulation of the structure of the Tetrabutylphosphonium Amino Acid Ionic Liquids
Study of Ionic Diffusion coefficients in 1-Alkyl-3-Methylimidazolium-Based ionic Liquids via Molecular Dynamics Simulation
Molecular dynamics simulation of NMR Lineshape Anisotropy of Guest Molecules within Inclusion Complexes
A structural study of the Amino Acid Ionic Liquids via Molecular Dynamics Simulation
Molecular dynamics studies of stabilities structures of two solid state phases of aspirin and its solubility in different solvents
Molecular dynamics study of thermal expansivity for sI and sII Clathrate Hydrates
Molecular dynamics simulations of sodium and potassium disilicate A universal equation of state
Dynamics in Room-temperature Ionic Liquids A Computer Simulation Study
A systematic structural study of 1-Alkyl-3-Methylimidazolium-Based Liquids via Molecular Dynamics Simulation
type: Journal
Title DOI Date
Molecular dynamics study of congruent melting of the equimolar ionic liquid benzene inclusion crystal emim NTf2 C6H6 #
Molecular Dynamics Simulation of Imidazolium-Based Ionic Liquids II. Transport coefficients #
Thermal Coinductivity Calculation of the Superceritical Fluids Based on the Modified Enskog Theory #
Molecular dynamics simulation of imidazolium-based ionic liquids.I. Dynamics and diffusion coefficient #