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.
184 related articles for article (PubMed ID: 21472960)
1. Mechanistic photodissociation of glycolaldehyde: insights from ab initio and RRKM calculations. Cui G; Fang W Chemphyschem; 2011 May; 12(7):1351-7. PubMed ID: 21472960 [TBL] [Abstract][Full Text] [Related]
2. Insights into photodissociation dynamics of acetaldehyde from ab initio calculations and molecular dynamics simulations. Chen S; Fang WH J Chem Phys; 2009 Aug; 131(5):054306. PubMed ID: 19673561 [TBL] [Abstract][Full Text] [Related]
3. Combined nonadiabatic transition-state theory and ab initio molecular dynamics study on selectivity of the alpha and beta bond fissions in photodissociation of bromoacetyl chloride. Zhang F; Ding WJ; Fang WH J Chem Phys; 2006 Nov; 125(18):184305. PubMed ID: 17115750 [TBL] [Abstract][Full Text] [Related]
4. Pulsed laser photolysis and quantum chemical-statistical rate study of the reaction of the ethynyl radical with water vapor. Carl SA; Nguyen HM; Elsamra RM; Nguyen MT; Peeters J J Chem Phys; 2005 Mar; 122(11):114307. PubMed ID: 15836215 [TBL] [Abstract][Full Text] [Related]
5. Wavelength-dependent photodissociation of benzoic acid monomer in alpha C-O fission. Fang Q; Liu YJ J Phys Chem A; 2010 Jan; 114(1):680-4. PubMed ID: 20020709 [TBL] [Abstract][Full Text] [Related]
6. Insights into mechanistic photodissociation of chloroacetone from a combination of electronic structure calculation and molecular dynamics simulation. Shen L; Liu L; Cao J; Fang WH J Chem Phys; 2011 Nov; 135(19):194305. PubMed ID: 22112080 [TBL] [Abstract][Full Text] [Related]
7. CASSCF and CASPT2 studies on the structures, transition energies, and dipole moments of ground and excited states for azulene. Murakami A; Kobayashi T; Goldberg A; Nakamura S J Chem Phys; 2004 Jan; 120(3):1245-52. PubMed ID: 15268250 [TBL] [Abstract][Full Text] [Related]
8. The photodissociation mechanisms of acrylonitrile: Ab initio calculations on reaction channels and surface intersections. Du WN; Luo C; Li ZS J Chem Phys; 2008 Nov; 129(17):174309. PubMed ID: 19045349 [TBL] [Abstract][Full Text] [Related]
9. Insights into mechanistic photochemistry of urea. Cui G; Ding L; Feng F; Liu Y; Fang W J Chem Phys; 2010 May; 132(19):194308. PubMed ID: 20499964 [TBL] [Abstract][Full Text] [Related]
10. A CASSCF and CASPT2 study on the excited states of s-trans-formaldazine. Luo C; Duan XM; Liu JY; Li ZS J Phys Chem A; 2008 Sep; 112(38):8979-85. PubMed ID: 18759422 [TBL] [Abstract][Full Text] [Related]
11. Probing mechanistic photochemistry of glyoxal in the gas phase by ab initio calculations of potential-energy surfaces and adiabatic and nonadiabatic rates. Li QS; Zhang F; Fang WH; Yu JG J Chem Phys; 2006 Feb; 124(5):054324. PubMed ID: 16468886 [TBL] [Abstract][Full Text] [Related]
12. Channels to singlet and triplet phenylcarbenes in phenyldiazomethane: a CASSCF and MRCI study. Cui G; Fang W Chemphyschem; 2011 Jun; 12(9):1689-96. PubMed ID: 21506234 [TBL] [Abstract][Full Text] [Related]
13. Time-resolved gas-phase kinetic and quantum chemical studies of the reaction of silylene with oxygen. Becerra R; Bowes SJ; Ogden JS; Cannady JP; Adamovic I; Gordon MS; Almond MJ; Walsh R Phys Chem Chem Phys; 2005 Aug; 7(15):2900-8. PubMed ID: 16189609 [TBL] [Abstract][Full Text] [Related]
14. Tunnelling under a conical intersection: application to the product vibrational state distributions in the UV photodissociation of phenols. Dixon RN; Oliver TA; Ashfold MN J Chem Phys; 2011 May; 134(19):194303. PubMed ID: 21599055 [TBL] [Abstract][Full Text] [Related]
15. Probing photophysical and photochemical processes of benzoic acid from ab initio calculations. Li J; Zhang F; Fang WH J Phys Chem A; 2005 Sep; 109(34):7718-24. PubMed ID: 16834147 [TBL] [Abstract][Full Text] [Related]
16. Multireference theoretical investigation on selectivity of the bond fissions in photodissociation of acetyl cyanide. Xiao HY; Liu YJ; Fang WH J Chem Phys; 2007 Dec; 127(24):244313. PubMed ID: 18163681 [TBL] [Abstract][Full Text] [Related]
17. Triplet- vs. singlet-state imposed photochemistry. The role of substituent effects on the photo-Fries and photodissociation reaction of triphenylmethyl silanes. Zarkadis AK; Georgakilas V; Perdikomatis GP; Trifonov A; Gurzadyan GG; Skoulika S; Siskos MG Photochem Photobiol Sci; 2005 Jun; 4(6):469-80. PubMed ID: 15920631 [TBL] [Abstract][Full Text] [Related]
18. Spin-orbit ab initio investigation of photolysis of o-, m-, and p-iodotoluene. Liu YJ; Tian YC; Fang WH J Chem Phys; 2010 Jan; 132(1):014306. PubMed ID: 20078160 [TBL] [Abstract][Full Text] [Related]
19. A theoretical investigation of p-hydroxyphenacyl caged phototrigger compounds: an examination of the excited state photochemistry of p-hydroxyphenacyl acetate. Chen X; Ma C; Kwok WM; Guan X; Du Y; Phillips DL J Phys Chem A; 2006 Nov; 110(45):12406-13. PubMed ID: 17091942 [TBL] [Abstract][Full Text] [Related]
20. Insights into the mechanistic photodissociation of methyl formate. Cui G; Zhang F; Fang W J Chem Phys; 2010 Jan; 132(3):034306. PubMed ID: 20095738 [TBL] [Abstract][Full Text] [Related] [Next] [New Search]