Binding Energies of N-bearing Species on Interstellar Water Ice Mantles by Quantum Chemical Calculations
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This dataset contains the atomic coordinates in XYZ format for the HF-3c optimized structures of N-bearing species adsorbed on the surfaces of both a periodic model of proton-ordered crystalline water ice and a periodic amorphous water ice model, obtained using the CRYSTAL17 computer code.
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Zenodo创建时间：
2025-02-04
