Data for Solvated Initial Conditions Paper
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https://zenodo.org/record/14538407
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资源简介:
Scripts, input files and molecular dynamics trajectories for paper (preprint available at https://doi.org/10.26434/chemrxiv-2024-nfsqp)about ideal ways to compute initial conditions for nonadiabatic dynamics simulations of chromophores in solution.
创建时间:
2024-12-21



