741 related articles for article (PubMed ID: 16774406)
1. Photoionization-induced dynamics of ammonia: ab initio potential energy surfaces and time-dependent wave packet calculations for the ammonia cation.
Viel A; Eisfeld W; Neumann S; Domcke W; Manthe U
J Chem Phys; 2006 Jun; 124(21):214306. PubMed ID: 16774406
[TBL] [Abstract][Full Text] [Related]
2. Quantum dynamics on a three-sheeted six-dimensional ab initio potential-energy surface of the phosphine cation: Simulation of the photoelectron spectrum and the ultrafast radiationless decay dynamics.
Bhattacharyya S; Dai Z; Domcke W
J Chem Phys; 2015 Nov; 143(19):194301. PubMed ID: 26590531
[TBL] [Abstract][Full Text] [Related]
3. Diradicals, antiaromaticity, and the pseudo-Jahn-Teller effect: electronic and rovibronic structures of the cyclopentadienyl cation.
Wörner HJ; Merkt F
J Chem Phys; 2007 Jul; 127(3):034303. PubMed ID: 17655439
[TBL] [Abstract][Full Text] [Related]
4. Photoinduced dynamics of ethene in the N, V, and Z valence states: a six-dimensional nonadiabatic quantum dynamics investigation.
Viel A; Krawczyk RP; Manthe U; Domcke W
J Chem Phys; 2004 Jun; 120(23):11000-10. PubMed ID: 15268130
[TBL] [Abstract][Full Text] [Related]
5. Multimode Jahn-Teller and pseudo-Jahn-Teller interactions in the cyclopropane radical cation: complex vibronic spectra and nonradiative decay dynamics.
Venkatesan TS; Mahapatra S; Meyer HD; Köppel H; Cederbaum LS
J Phys Chem A; 2007 Mar; 111(10):1746-61. PubMed ID: 17300181
[TBL] [Abstract][Full Text] [Related]
6. Pseudo-Jahn-Teller origin of the low barrier hydrogen bond in N(2)H(7) (+).
García-Fernández P; García-Canales L; García-Lastra JM; Junquera J; Moreno M; Aramburu JA
J Chem Phys; 2008 Sep; 129(12):124313. PubMed ID: 19045029
[TBL] [Abstract][Full Text] [Related]
7. High-order expansion of T(2)xt(2) Jahn-Teller potential-energy surfaces in tetrahedral molecules.
Opalka D; Domcke W
J Chem Phys; 2010 Apr; 132(15):154108. PubMed ID: 20423169
[TBL] [Abstract][Full Text] [Related]
8. Higher order (A+E) multiply sign in circle e pseudo-Jahn-Teller coupling.
Eisfeld W; Viel A
J Chem Phys; 2005 May; 122(20):204317. PubMed ID: 15945734
[TBL] [Abstract][Full Text] [Related]
9. Jahn-Teller effect in van der Waals complexes; Ar-C6H6 + and Ar-C6D6 +.
van der Avoird A; Lotrich VF
J Chem Phys; 2004 Jun; 120(21):10069-83. PubMed ID: 15268029
[TBL] [Abstract][Full Text] [Related]
10. The Jahn-Teller and pseudo-Jahn-Teller effects in the anion photoelectron spectroscopy of B3 cluster.
Venkatesan TS; Deepika K; Mahapatra S
J Comput Chem; 2006 Jul; 27(10):1093-100. PubMed ID: 16691569
[TBL] [Abstract][Full Text] [Related]
11. Towards a highly efficient theoretical treatment of Jahn-Teller effects in molecular spectra: the 1 2A and 2 2A electronic states of the ethoxy radical.
Young RA; Yarkony DR
J Chem Phys; 2006 Dec; 125(23):234301. PubMed ID: 17190552
[TBL] [Abstract][Full Text] [Related]
12. The vibronic level structure of the cyclopentadienyl radical.
Ichino T; Wren SW; Vogelhuber KM; Gianola AJ; Lineberger WC; Stanton JF
J Chem Phys; 2008 Aug; 129(8):084310. PubMed ID: 19044826
[TBL] [Abstract][Full Text] [Related]
13. Nonadiabatic nuclear dynamics of the ammonia cation studied by surface hopping classical trajectory calculations.
Belyaev AK; Domcke W; Lasser C; Trigila G
J Chem Phys; 2015 Mar; 142(10):104307. PubMed ID: 25770540
[TBL] [Abstract][Full Text] [Related]
14. On the (Emultiply sign in circlee)-Jahn-Teller conical intersections in the 3p(E') and 3d(E") Rydberg electronic states of triatomic hydrogen.
Jayachander Rao B; Mahapatra S; Köppel H; Jungen M
J Chem Phys; 2005 Oct; 123(13):134325. PubMed ID: 16223306
[TBL] [Abstract][Full Text] [Related]
15. The Jahn-Teller and pseudo-Jahn-Teller effects in the low-lying electronic states of 1,3,5-trifluorobenzene radical cation.
Mondal T; Mahapatra S
Phys Chem Chem Phys; 2009 Dec; 11(46):10867-80. PubMed ID: 19924321
[TBL] [Abstract][Full Text] [Related]
16. A time-dependent wave packet study of the vibronic and spin-orbit interactions in the dynamics of Cl((2)P)+H(2)-->HCl(X (1)Sigma(g) (+))+H((2)S) reaction.
Ghosal S; Mahapatra S
J Chem Phys; 2004 Sep; 121(12):5740-53. PubMed ID: 15366998
[TBL] [Abstract][Full Text] [Related]
17. Theoretical study of excitations in furan: spectra and molecular dynamics.
Gromov EV; Trofimov AB; Vitkovskaya NM; Köppel H; Schirmer J; Meyer HD; Cederbaum LS
J Chem Phys; 2004 Sep; 121(10):4585-98. PubMed ID: 15332889
[TBL] [Abstract][Full Text] [Related]
18. DFT-based studies on the Jahn-Teller effect in 3d hexacyanometalates with orbitally degenerate ground states.
Atanasov M; Comba P; Daul CA; Hauser A
J Phys Chem A; 2007 Sep; 111(37):9145-63. PubMed ID: 17718456
[TBL] [Abstract][Full Text] [Related]
19. Interpreting ultrafast molecular fragmentation dynamics with ab initio electronic structure calculations.
Trallero C; Pearson BJ; Weinacht T; Gilliard K; Matsika S
J Chem Phys; 2008 Mar; 128(12):124107. PubMed ID: 18376908
[TBL] [Abstract][Full Text] [Related]
20. Ab initio ground and excited state potential energy surfaces for NO-Kr complex and dynamics of Kr solids with NO impurity.
Castro-Palacios JC; Rubayo-Soneira J; Ishii K; Yamashita K
J Chem Phys; 2007 Apr; 126(13):134315. PubMed ID: 17430040
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]