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 Date: 2014-09-03 08:10:08Bond-dissociation energy Theoretical chemistry Computational chemistry Hybrid functional |
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Date: 2014-09-03 08:10:08Bond-dissociation energy Theoretical chemistry Computational chemistry Hybrid functional |
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Article pubs.acs.org/JPCA Alternative Approach to Chemical Accuracy: A Neural NetworksBased First-Principles Method for Heat of Formation of Molecules Made of H, C, N, O, F, S, and Cl Jian Sun,*,† Jiang Wu,† Tao Song