共 50 条
- [1] N-methylacetamide in the gravy of methanol: Ab initio molecular dynamics studyABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2014, 248Yadav, Vivek KumarBankura, ArindamKlein, Michael L.
- [2] Probing the dynamics of N-methylacetamide in methanol via ab initio molecular dynamicsPHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2017, 19 (20) : 12868 - 12875Yadav, Vivek K.Klein, Michael L.
- [3] Hydrogen bond dynamics and vibrational spectroscopy of aqueous system: An ab initio molecular dynamics studyABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2012, 244Karmakar, Anwesa
- [4] An ab initio molecular dynamics study of supercritical aqueous ionic solutions: Hydrogen bonding, rotational dynamics and vibrational spectral diffusionCHEMICAL PHYSICS, 2011, 387 (1-3) : 48 - 55Mallik, Bhabani S.Chandra, Amalendu
- [5] Effects of methanol on the hydrogen bonding structure and dynamics in aqueous N-methylacetamide solutionJOURNAL OF MOLECULAR LIQUIDS, 2014, 194 : 141 - 148Pattanayak, Subrat KumarChowdhuri, Snehasis
- [6] First-Principles Simulation Study of Vibrational Spectral Diffusion and Hydrogen Bond Fluctuations in Aqueous Solution of N-MethylacetamideJOURNAL OF PHYSICAL CHEMISTRY B, 2015, 119 (30) : 9858 - 9867Yadav, Vivek KumarChandra, Amalendu
- [7] Aqueous N-methylacetamide: New analytic potentials and a molecular dynamics studyJOURNAL OF MOLECULAR LIQUIDS, 2016, 224 : 792 - 800Faginas-Lago, NoeliaLombardi, AndreaAlberti, Margarita
- [8] Hydrogen bond dynamics and vibrational spectral diffusion in aqueous solution of acetone: A first principles molecular dynamics studyJOURNAL OF CHEMICAL SCIENCES, 2012, 124 (01) : 215 - 221Mallik, Bhabani S.Chandra, Amalendu
- [10] Hydrogen bond dynamics and vibrational spectral diffusion in aqueous solution of formaldehyde: a first principles molecular dynamics studyTheoretical Chemistry Accounts, 2018, 137Vivek Kumar Yadav