These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.
235 related articles for article (PubMed ID: 17166015)
1. Quartet states of the acetylene cation: electronic structure calculations and spin-orbit coupling terms. Hochlaf M; Taylor S; Eland JH J Chem Phys; 2006 Dec; 125(21):214301. PubMed ID: 17166015 [TBL] [Abstract][Full Text] [Related]
2. Spectroscopic and spin-orbit calculations on the SO+ radical cation. Ben Houria A; Ben Lakhdar Z; Hochlaf M J Chem Phys; 2006 Feb; 124(5):054313. PubMed ID: 16468875 [TBL] [Abstract][Full Text] [Related]
3. Extensive theoretical study on the low-lying electronic states of silicon monofluoride cation including spin-orbit coupling. Liu K; Bian W J Comput Chem; 2008 Jan; 29(2):256-65. PubMed ID: 17570130 [TBL] [Abstract][Full Text] [Related]
4. Rovibrational dynamics of the strontium molecule in the A(1)Σ(u)+, c(3)Π(u), and a(3)Σ(u)+ manifold from state-of-the-art ab initio calculations. Skomorowski W; Pawłowski F; Koch CP; Moszynski R J Chem Phys; 2012 May; 136(19):194306. PubMed ID: 22612094 [TBL] [Abstract][Full Text] [Related]
5. 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]
6. Experimental and theoretical study of the photodissociation reaction of thiophenol at 243 nm: intramolecular orbital alignment of the phenylthiyl radical. Lim IS; Lim JS; Lee YS; Kim SK J Chem Phys; 2007 Jan; 126(3):034306. PubMed ID: 17249870 [TBL] [Abstract][Full Text] [Related]
7. Spin-orbit coupling in O2(upsilon)+O2 collisions: I. Electronic structure calculations on dimer states involving the X 3Sigmag-, a 1Deltag, and b 1Sigmag+ states of O2. Dayou F; Hernández MI; Campos-Martínez J; Hernández-Lamoneda R J Chem Phys; 2005 Aug; 123(7):074311. PubMed ID: 16229574 [TBL] [Abstract][Full Text] [Related]
8. Reactivity of the NO dimer: on the role of the triplet electronic states. Marouani S; Bahri M; Batis H; Hochlaf M J Phys Chem A; 2010 Mar; 114(9):3025-30. PubMed ID: 19743862 [TBL] [Abstract][Full Text] [Related]
9. Extensive theoretical study on electronically excited states and predissociation mechanisms of sulfur monoxide including spin-orbit coupling. Yu L; Bian W J Comput Chem; 2011 Jun; 32(8):1577-88. PubMed ID: 21284007 [TBL] [Abstract][Full Text] [Related]
10. Ab initio treatment of the chemical reaction precursor complex Br(2P)-HCN. 1. Adiabatic and diabatic potential surfaces. Fishchuk AV; Merritt JM; van der Avoird A J Phys Chem A; 2007 Aug; 111(31):7262-9. PubMed ID: 17567108 [TBL] [Abstract][Full Text] [Related]
11. 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]
12. Theoretical spectroscopy of the calcium dimer in the A 1Sigma(u)+, c3Pi(u), and a3Sigma(u)+ manifolds: an ab initio nonadiabatic treatment. Bussery-Honvault B; Launay JM; Korona T; Moszynski R J Chem Phys; 2006 Sep; 125(11):114315. PubMed ID: 16999482 [TBL] [Abstract][Full Text] [Related]
13. Ab initio potential energy surfaces, bound states, and electronic spectrum of the Ar-SH complex. Doyle RJ; Hirst DM; Hutson JM J Chem Phys; 2006 Nov; 125(18):184312. PubMed ID: 17115757 [TBL] [Abstract][Full Text] [Related]
14. 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]
15. A Theoretical Investigation of the Renner Interactions and Magnetic Dipole Transitions in the Ã-&Xtilde; Electronic Band System of HO(2). Osmann G; Bunker PR; Jensen P; Buenker RJ; Gu Jp; Hirsch G J Mol Spectrosc; 1999 Oct; 197(2):262-274. PubMed ID: 10479592 [TBL] [Abstract][Full Text] [Related]
16. 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]
17. Butterfly C2H2++: new way for the decomposition of the acetylene dication. Palaudoux J; Hochlaf M J Chem Phys; 2007 Jan; 126(4):044302. PubMed ID: 17286465 [TBL] [Abstract][Full Text] [Related]
18. A diabatic representation including both valence nonadiabatic interactions and spin-orbit effects for reaction dynamics. Valero R; Truhlar DG J Phys Chem A; 2007 Sep; 111(35):8536-51. PubMed ID: 17691756 [TBL] [Abstract][Full Text] [Related]
19. Vacuum ultraviolet photoionization of C3. Nicolas C; Shu J; Peterka DS; Hochlaf M; Poisson L; Leone SR; Ahmed M J Am Chem Soc; 2006 Jan; 128(1):220-6. PubMed ID: 16390150 [TBL] [Abstract][Full Text] [Related]
20. The electronic states of SeF: A reinterpretation of the chemiluminescent emission of the reaction of selenium with fluorine. Hermoso W; Ornellas FR J Chem Phys; 2010 May; 132(19):194316. PubMed ID: 20499972 [TBL] [Abstract][Full Text] [Related] [Next] [New Search]