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Issue DateTitleAuthor(s)
29-Dec-2005Ab initio characterization of electron transfer coupling in photoinduced systems: Generalized Mulliken-Hush with configuration-interaction singlesChen, HC; Hsu, CP; 應用化學系分子科學碩博班; Institute of Molecular science
14-Jan-2010Ab Initio Chemical Kinetic Study for Reactions of H Atoms with SiH(4) and Si(2)H(6): Comparison of Theory and ExperimentWu, S. Y.; Raghunath, P.; Wu, J. S.; Lin, M. C.; 機械工程學系; 應用化學系分子科學碩博班; Department of Mechanical Engineering; Institute of Molecular science
14-Jan-2010Ab Initio Chemical Kinetic Study for Reactions of H Atoms with SiH4 and Si2H6: Comparison of Theory and ExperimentWu, S. Y.; Raghunath, P.; Wu, J. S.; Lin, M. C.; 機械工程學系; 應用化學系分子科學碩博班; Department of Mechanical Engineering; Institute of Molecular science
18-Jul-2013Ab Initio Chemical Kinetics for H plus NCN: Prediction of NCN Heat of Formation and Reaction Product Branching via Doublet and Quartet SurfacesTeng, Wen-Shuang; Moskaleva, Lyudmila V.; Chen, Hui-Lung; Lin, M. C.; 應用化學系; 應用化學系分子科學碩博班; Department of Applied Chemistry; Institute of Molecular science
30-Dec-2010Ab Initio Chemical Kinetics for SiH(3) Reactions with Si(x)H(2x+2) (x=1-4)Raghunath, P.; Lin, M. C.; 應用化學系分子科學碩博班; Institute of Molecular science
30-Dec-2010Ab Initio Chemical Kinetics for SiH3 Reactions with SixH2x+2 (x=1-4)Raghunath, P.; Lin, M. C.; 應用化學系分子科學碩博班; Institute of Molecular science
22-Apr-2010Ab Initio Chemical Kinetics for Singlet CH(2) Reaction with N(2) and the Related Decomposition of DiazomethaneXu, Shucheng; Lin, M. C.; 應用化學系分子科學碩博班; Institute of Molecular science
22-Apr-2010Ab Initio Chemical Kinetics for Singlet CH2 Reaction with N-2 and the Related Decomposition of DiazomethaneXu, Shucheng; Lin, M. C.; 應用化學系分子科學碩博班; Institute of Molecular science
10-May-2012Ab Initio Chemical Kinetics for the Hydrolysis of N2O4 Isomers in the Gas PhaseZhu, R. S.; Lai, Ke-Yu; Lin, M. C.; 應用化學系分子科學碩博班; Institute of Molecular science
1-Nov-2009Ab Initio Chemical Kinetics for the NH(2) + HNO(x) Reactions, Part I: Kinetics and Mechanism for NH(2) + HNOXu, Shucheng; Lin, M. C.; 應用化學系分子科學碩博班; Institute of Molecular science
1-Nov-2009Ab initio Chemical Kinetics for the NH(2) + HNO(x) Reactions, Part II: Kinetics and Mechanism for NH(2) + HONOXu, Shucheng; Lin, M. C.; 應用化學系分子科學碩博班; Institute of Molecular science
1-Feb-2010Ab Initio Chemical Kinetics for the NH(2) + HNO(x) Reactions, Part III: Kinetics and Mechanism for NH(2) + HONO(2)Xu, Shucheng; Lin, M. C.; 應用化學系分子科學碩博班; Institute of Molecular science
26-Jul-2007Ab initio chemical kinetics for the OH plus HNCN reactionXu, Shucheng; Lin, M. C.; 應用化學系分子科學碩博班; Institute of Molecular science
18-Mar-2010Ab Initio Chemical Kinetics for the Reaction of an H Atom with Si(3)H(8)Varma, D. H.; Raghunath, P.; Lin, M. C.; 應用化學系分子科學碩博班; Institute of Molecular science
18-Mar-2010Ab Initio Chemical Kinetics for the Reaction of an H Atom with Si3H8Varma, D. H.; Raghunath, P.; Lin, M. C.; 應用化學系分子科學碩博班; Institute of Molecular science
1-Jan-2009Ab initio chemical kinetics for the reactions of HNCN with O((3)P) and O(2)Xu, Shucheng; Lin, M. C.; 應用化學系分子科學碩博班; Institute of Molecular science
2009Ab initio chemical kinetics for the reactions of HNCN with O(P-3) and O-2Xu, Shucheng; Lin, M. C.; 應用化學系分子科學碩博班; Institute of Molecular science
15-Feb-2014Ab Initio Chemical Kinetics for the Unimolecular Decomposition of Si2H5 Radical and Related Reverse Bimolecular ReactionsWu, Shang-Ying; Lee, Yun-Min; Wu, Jong-Shinn; Lin, Ming-Chang; 機械工程學系; 應用化學系分子科學碩博班; Department of Mechanical Engineering; Institute of Molecular science
1-Jan-2015Ab initio quantum dynamical analysis of ultrafast nonradiative transitions via conical intersections in pyrazineKanno, Manabu; Ito, Yuta; Shimakura, Noriyuki; Koseki, Shiro; Kono, Hirohiko; Fujimura, Yuichi; 應用化學系分子科學碩博班; Institute of Molecular science
1-Jan-2015Ab Initio Quantum Dynamical Study on Ultrafast Nonradiative Transition Pathways of PyrazineKanno, Manabu; Ito, Yuta; Shimakura, Noriyuki; Koseki, Shiro; Kono, Hirohiko; Fujimura, Yuichi; 應用化學系分子科學碩博班; Institute of Molecular science