Showing results 1 to 4 of 4
Issue Date | Title | Author(s) |
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2023-09 | Excited-state intramolecular proton transfer in 10-hydroxybenzoquinoline, 1-hydroxyanthraquinone, methyl salicylate and 4-methyl-2,6-diformyl phenol: a QM/MM-MD study | Rashid, Md Al Mamunur; Acter, Thamina; Uddin, Nizam |
2023-12 | Identifying the acidic or basic behavior of surface water: a QM/MM-MD study | Rashid, Md Al Mamunur; Rahman, Mofizur; Acter, Thamina; Uddin, Nizam |
2024-01 | Li+-Li+ and Na+-Li+ ion pairs in aqueous solution | Rashid, Md Al Mamunur; Acter, Thamina; Uddin, Nizam |
2023-12 | The solvation dynamics of CO2 by quantum mechanical molecular dynamics | Rashid, Md Al Mamunur; Acter, Thamina; Uddin, Nizam |