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Takatsuka, Kazuo, Yonehara, Takehiro (2011) Exploring dynamical electron theory beyond the Born–Oppenheimer framework: from chemical reactivity to non-adiabatically coupled electronic and nuclear wavepackets on-the-fly under laser field. Physical Chemistry Chemical Physics, 13 (11). 4987pp. doi:10.1039/c0cp00937g

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Reference TypeJournal (article/letter/editorial)
TitleExploring dynamical electron theory beyond the Born–Oppenheimer framework: from chemical reactivity to non-adiabatically coupled electronic and nuclear wavepackets on-the-fly under laser field
JournalPhysical Chemistry Chemical Physics
AuthorsTakatsuka, KazuoAuthor
Yonehara, TakehiroAuthor
Year2011Volume13
Issue11
PublisherRoyal Society of Chemistry (RSC)
DOIdoi:10.1039/c0cp00937gSearch in ResearchGate
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Mindat Ref. ID4014485Long-form Identifiermindat:1:5:4014485:4
GUID0
Full ReferenceTakatsuka, Kazuo, Yonehara, Takehiro (2011) Exploring dynamical electron theory beyond the Born–Oppenheimer framework: from chemical reactivity to non-adiabatically coupled electronic and nuclear wavepackets on-the-fly under laser field. Physical Chemistry Chemical Physics, 13 (11). 4987pp. doi:10.1039/c0cp00937g
Plain TextTakatsuka, Kazuo, Yonehara, Takehiro (2011) Exploring dynamical electron theory beyond the Born–Oppenheimer framework: from chemical reactivity to non-adiabatically coupled electronic and nuclear wavepackets on-the-fly under laser field. Physical Chemistry Chemical Physics, 13 (11). 4987pp. doi:10.1039/c0cp00937g
In(2011) Physical Chemistry Chemical Physics Vol. 13 (11) Royal Society of Chemistry (RSC)

See Also

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Yonehara, Takehiro, Takahashi, Satoshi, Takatsuka, Kazuo (2009) Non-Born–Oppenheimer electronic and nuclear wavepacket dynamics. The Journal of Chemical Physics, 130 (21). 214113pp. doi:10.1063/1.3151684
Yonehara, Takehiro, Takatsuka, Kazuo (2010) Non-Born–Oppenheimer quantum chemistry on the fly with continuous path branching due to nonadiabatic and intense optical interactions. The Journal of Chemical Physics, 132 (24). 244102pp. doi:10.1063/1.3439396
Yonehara, Takehiro, Hanasaki, Kota, Takatsuka, Kazuo (2012) Fundamental Approaches to Nonadiabaticity: Toward a Chemical Theory beyond the Born–Oppenheimer Paradigm. Chemical Reviews, 112 (1) 499-542 doi:10.1021/cr200096s
Manz, Jörn (2015) Chemical Theory beyond the Born–Oppenheimer Paradigm. Nonadiabatic Electronic and Nuclear Dynamics in Chemical Reactions. Von Kazuo Takatsuka, Takehiro Yonehara, Kota Hanasaki und Yasuki Arasaki. Angewandte Chemie, 127 (45). 13360 doi:10.1002/ange.201508242
Manz, Jörn (2015) Chemical Theory beyond the Born–Oppenheimer Paradigm. Nonadiabatic Electronic and Nuclear Dynamics in Chemical Reactions. By Kazuo Takatsuka, Takehiro Yonehara, Kota Hanasaki, and Yasuki Arasaki. Angewandte Chemie International Edition, 54 (45). 13164 doi:10.1002/anie.201508242
Yonehara, Takehiro, Takatsuka, Kazuo (2012) Electron wavepacket dynamics in highly quasi-degenerate coupled electronic states: A theory for chemistry where the notion of adiabatic potential energy surface loses the sense. The Journal of Chemical Physics, 137 (22). 22pp. doi:10.1063/1.4742155
Yonehara, Takehiro, Takatsuka, Kazuo (2008) Phase-space averaging and natural branching of nuclear paths for nonadiabatic electron wavepacket dynamics. The Journal of Chemical Physics, 129 (13). 134109pp. doi:10.1063/1.2987302
Yonehara, Takehiro, Takatsuka, Kazuo (2009) Characterization of electron-deficient chemical bonding of diborane with attosecond electron wavepacket dynamics and laser response. Chemical Physics, 366. 115-128 doi:10.1016/j.chemphys.2009.09.001
Yonehara, Takehiro, Takatsuka, Kazuo (2008) Nonadiabatic electron wavepacket dynamics of molecules in an intense optical field: An ab initio electronic state study. The Journal of Chemical Physics, 128 (15). 154104pp. doi:10.1063/1.2904867
Yamamoto, Kentaro, Takatsuka, Kazuo (2014) Electronic quantum effects mapped onto non-Born-Oppenheimer nuclear paths: Nonclassical surmounting over potential barriers and trapping above the transition states due to nonadiabatic path-branching. The Journal of Chemical Physics, 140 (12). 124111pp. doi:10.1063/1.4869191
Yonehara, Takehiro, Takatsuka, Kazuo (2016) Nonadiabtic electron dynamics in densely quasidegenerate states in highly excited boron cluster. The Journal of Chemical Physics, 144 (16). 164304pp. doi:10.1063/1.4947302
 
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