Lv4
496 积分 2024-03-06 加入
A general purpose model for the condensed phases of water: TIP4P/2005
27天前
已完结
Development and Testing of the OPLS All-Atom Force Field on Conformational Energetics and Properties of Organic Liquids
27天前
已完结
Development and testing of a general amber force field
27天前
已完结
Generative Artificial Intelligence Navigated Development of Solvents for Next Generation High‐Performance Magnesium Batteries
1个月前
已完结
Ionization Potential, Electron Affinity, Electronegativity, Hardness, and Electron Excitation Energy: Molecular Properties from Density Functional Theory Orbital Energies
2个月前
已完结
A transferable classical force field to describe glyme based lithium solvate ionic liquids
2个月前
已完结
Solvation of Mg2+ Ions in Mg(TFSI)2Dimethoxyethane ElectrolytesA View from Molecular Dynamics Simulations
2个月前
已完结
Solvation of Mg2+ Ions in Mg(TFSI)2Dimethoxyethane ElectrolytesA View from Molecular Dynamics Simulations
2个月前
已完结
Unique Behavior of Dimethoxyethane (DME)/Mg(N(SO2CF3)2)2 Solutions
2个月前
已完结
The Coupling between Stability and Ion Pair Formation in Magnesium Electrolytes from First-Principles Quantum Mechanics and Classical Molecular Dynamics
2个月前
已完结
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