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机译:
Faculty of Chemistry, A. Mickiewicz University, Grunwaldzka 6, PL 60-780 Pozna, Poland;
机译:Beijing National Laboratory for Molecular Sciences (BNLMS) Reports Findings in Chemicals and Chemistry (An Ab Initio Neural Network Potential Energy Surface for the Dimer of Formic Acid and Further Quantum Tunneling Dynamics)
机译:A full-dimensional ab initio intermolecular potential energy surface and ro-vibrational spectra for N-2-HF and N-2-DF
机译:Vibrational shifts induced by ~(13)C Isotopic substitutions in a surface adsorbate determined by infrared spectroscopy and Ab initio calculations
机译:将AB Initio Energy纳入蛋白质结构预测的穿线方法
机译:ab initio molecular orbital studies of some novel moleuclar species and their potential energy surfaces.