Tetramethylammonium–acetate solution molecular dynamics simulations
收藏官方服务：
资源简介：
Simulation data used for the publication: "Ion pairing in aqueous tetramethylammonium–acetate solutions by neutron scattering and molecular dynamics simulations". GROMACS FFMD simulations: SI-charmm-full SI-charmm-ecc85 SI-charmm-ecc75 SI-charmm-lowCH SI-charmm-lowCO SI-charmm-highCO SI-amber-full SI-amber-ecc85 SI-amber-ecc75 SI-FFMD-for-AIMD-1tma-1acet CP2K AIMD simulation: SI-AIMD
提供机构：
Zenodo创建时间：
2024-11-07
