303 related articles for article (PubMed ID: 11148092)
1. Ab Initio Investigation of the ellipsis pi(2)(g) (X(3)Sigma(-)(g), 1(1)Delta(g), 1(1)Sigma(+)(g)) Electronic States of NCN. Study of the Renner-Teller Effect in the 1(1)Delta(g) State.
Peric M; Krmar M; Radic-Peric J; Hanrath M
J Mol Spectrosc; 2000 Dec; 204(2):226-234. PubMed ID: 11148092
[TBL] [Abstract][Full Text] [Related]
2. Experimental and ab initio study of a new D 1Deltag state of the C3 radical.
Saha S; Western CM
J Chem Phys; 2006 Dec; 125(22):224307. PubMed ID: 17176141
[TBL] [Abstract][Full Text] [Related]
3. An ab initio study of the vibronic structure in the a1Delta g electronic state of C2H2++.
Perić M; Palaudoux J; Hochlaf M
J Phys Chem A; 2008 Jan; 112(4):768-74. PubMed ID: 18181588
[TBL] [Abstract][Full Text] [Related]
4. An ab initio study of the low-lying electronic states of S3.
Peterson KA; Lyons JR; Francisco JS
J Chem Phys; 2006 Aug; 125(8):084314. PubMed ID: 16965019
[TBL] [Abstract][Full Text] [Related]
5. Giant Renner-Teller vibronic coupling in the BF2 radical: an ab initio study of the X (2)A1 and A (2)Pi electronic states.
Tarroni R; Clouthier DJ
J Chem Phys; 2010 Aug; 133(6):064304. PubMed ID: 20707567
[TBL] [Abstract][Full Text] [Related]
6. An ab initio calculation of the vibronic energy levels of the X (2)Pi and 1 (2)Delta electronic states of C(2)P.
Jerosimić S; Perić M
J Chem Phys; 2008 Oct; 129(14):144305. PubMed ID: 19045145
[TBL] [Abstract][Full Text] [Related]
7. Ab initio calculations and vibrational energy level fits for the lower singlet potential-energy surfaces of C3.
Ahmed K; Balint-Kurti GG; Western CM
J Chem Phys; 2004 Nov; 121(20):10041-51. PubMed ID: 15549879
[TBL] [Abstract][Full Text] [Related]
8. An ab initio study of the hyperfine structure in the X2 Pi electronic state of CCCH.
Perić M; Mladenović M; Engels B
J Chem Phys; 2004 Aug; 121(6):2636-45. PubMed ID: 15281863
[TBL] [Abstract][Full Text] [Related]
9. Calculation of the vibronic structure of the X2Pi photoelectron spectra of XCN, X=F, Cl, and Br.
Mishra S; Vallet V; Poluyanov LV; Domcke W
J Chem Phys; 2006 Jan; 124(4):044317. PubMed ID: 16460172
[TBL] [Abstract][Full Text] [Related]
10. Ab Initio Study of the Electronic Spectrum of the SiO(+) Cation.
Cai Z; François JP
J Mol Spectrosc; 1999 Sep; 197(1):12-18. PubMed ID: 10438636
[TBL] [Abstract][Full Text] [Related]
11. Spin-orbit coupling in O2(v)+O2 collisions. II. Quantum scattering calculations on dimer states involving the X 3 Sigma g -, a 1 Delta g, and b 1 Sigma g + states of O2.
Dayou F; Hernández MI; Campos-Martínez J; Hernández-Lamoneda R
J Chem Phys; 2007 May; 126(19):194309. PubMed ID: 17523806
[TBL] [Abstract][Full Text] [Related]
12. Ab initio study of the spectroscopy of AgBr: a CASSCF + Averaged Coupled Pair Functional approach to the lowest excited states including spin-orbit couplings.
Amaro-Estrada JI; Ramírez-Solís A
J Chem Phys; 2009 Sep; 131(12):124308. PubMed ID: 19791882
[TBL] [Abstract][Full Text] [Related]
13. Ab initio study of the mechanism for photoinduced Yl-oxygen exchange in uranyl(VI) in acidic aqueous solution.
Réal F; Vallet V; Wahlgren U; Grenthe I
J Am Chem Soc; 2008 Sep; 130(35):11742-51. PubMed ID: 18686948
[TBL] [Abstract][Full Text] [Related]
14. The electronic spectrum of the C2P free radical and a Renner-Teller analysis of the 2Delta and X 2Pi electronic states.
Sunahori FX; Wei J; Clouthier DJ
J Chem Phys; 2008 Jun; 128(24):244311. PubMed ID: 18601336
[TBL] [Abstract][Full Text] [Related]
15. Ab initio potential energy surfaces, total absorption cross sections, and product quantum state distributions for the low-lying electronic states of N(2)O.
Daud MN; Balint-Kurti GG; Brown A
J Chem Phys; 2005 Feb; 122(5):54305. PubMed ID: 15740320
[TBL] [Abstract][Full Text] [Related]
16. Theoretical study on the predissociation mechanism of CO(2)(+) (C (2)Sigma(g)(+)).
Meng Q; Huang MB; Chang HB
J Phys Chem A; 2009 Nov; 113(46):12825-30. PubMed ID: 19795827
[TBL] [Abstract][Full Text] [Related]
17. An ab initio calculation of the anisotropic hyperfine coupling constants in the low-lying vibronic levels of the X 2Pi electronic state of CCCH.
Mladenović M; Perić M; Engels B
J Chem Phys; 2004 Dec; 121(24):12361-70. PubMed ID: 15606255
[TBL] [Abstract][Full Text] [Related]
18. Renner-Teller and spin-orbit vibronic coupling effects in linear triatomic molecules with a half-filled pi shell.
Sioutis I; Mishra S; Poluyanov LV; Domcke W
J Chem Phys; 2008 Mar; 128(12):124318. PubMed ID: 18376930
[TBL] [Abstract][Full Text] [Related]
19. MRCI study on electronic spectrum of 13 electronic states of SiP molecule.
Shi D; Xing W; Liu H; Sun J; Zhu Z
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Nov; 97():536-45. PubMed ID: 22842348
[TBL] [Abstract][Full Text] [Related]
20. 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]
[Next] [New Search]
