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| 國立交通大學 |
2020-07-01T05:22:04Z |
Quantum yields of singlet and triplet chemiexcitation of dimethyl 1,2-dioxetane: ab initio nonadiabatic molecular dynamic simulations
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Yue, Ling; Yu, Le; Xu, Chao; Zhu, Chaoyuan; Liu, Yajun |
| 國立交通大學 |
2019-04-02T06:00:32Z |
Performance of TDDFT with and without spin-flip in trajectory surface hopping dynamics: cis-trans azobenzene photoisomerization
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Yue, Ling; Liu, Yajun; Zhu, Chaoyuan |
| 國立交通大學 |
2018-08-21T05:54:07Z |
Benchmark Performance of Global Switching versus Local Switching for Trajectory Surface Hopping Molecular Dynamics Simulation: Cis <-> Trans Azobenzene Photoisomerization
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Yue, Ling; Yu, Le; Xu, Chao; Lei, Yibo; Liu, Yajun; Zhu, Chaoyuan |
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