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158 积分 2025-03-14 加入
Accurate and Efficient Schemes for Mapping Out Two Isolated Seams of Conical Intersections with Neural Networks Solely Based on Adiabatic Energies: A Case Study of H+ + NO(X2Π) → H + NO+(X1Σ+)
5小时前
已完结
Transfer Learning for Predictive Molecular Simulations: Data-Efficient Potential Energy Surfaces at CCSD(T) Accuracy
19天前
已完结
Electronically Nonadiabatic Quenching of Excited States of O2 by Collisions with O Atoms
3个月前
已完结
Theoretical study of the O(3P) + CN(X2Σ+) → CO(X1Σ+) + N(2D)/N(4S) reactions
3个月前
已关闭
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