Berlin 2014 –
wissenschaftliches Programm
MO 18: Theory 3: Quantum Chemistry
Donnerstag, 20. März 2014, 14:00–15:45, BEBEL SR144
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14:00 |
MO 18.1 |
Auger decay of double core holes in small linear molecules — •Ludger Inhester, Gerrit Groenhof, and Helmut Grubmüller
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14:15 |
MO 18.2 |
Exact Factorization of the Electron-Nuclear Wavefunction: Exact Electronic Potentials in Coupled Electron-Ion Dynamics — •Yasumitsu Suzuki, Ali Abedi, Neepa Maitra, Koichi Yamashita, and E. K. U. Gross
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14:30 |
MO 18.3 |
Exact factorization of the electron-nuclear wave function: Applications — •Federica Agostini
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14:45 |
MO 18.4 |
The contribution has been withdrawn.
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15:00 |
MO 18.5 |
Exact factorization of the time-dependent electron-nuclear wavefunction — Ali Abedi, •Federica Agostini, Neepa Maitra, and E. K. U. Gross
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15:15 |
MO 18.6 |
Chromium: Benchmark for DFT — •Rolf Würdemann and Michael Walter
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15:30 |
MO 18.7 |
Reflectance Anisotropy spectrum of water covered Cu(110) surface studied from first principles. — •Amirreza Baghbanpourasl, Kurt Hingerl, and Wolf Gero Schmidt
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