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.
174 related articles for article (PubMed ID: 25705857)
21. Theoretical and experimental studies on the mechanism of norbornadiene Pauson-Khand cycloadducts photorearrangement. Is there a pathway on the excited singlet potential energy surface? Olivella S; Solé A; Lledó A; Ji Y; Verdaguer X; Suau R; Riera A J Am Chem Soc; 2008 Dec; 130(50):16898-907. PubMed ID: 19053466 [TBL] [Abstract][Full Text] [Related]
22. Machine Learning-Assisted Mixed Quantum-Classical Dynamics without Explicit Nonadiabatic Coupling: Application to the Photodissociation of Peroxynitric Acid. Sit MK; Das S; Samanta K J Phys Chem A; 2024 Sep; 128(38):8244-8253. PubMed ID: 39283987 [TBL] [Abstract][Full Text] [Related]
23. Imaging the molecular channel in acetaldehyde photodissociation: roaming and transition state mechanisms. Rubio-Lago L; Amaral GA; Arregui A; González-Vázquez J; Bañares L Phys Chem Chem Phys; 2012 May; 14(17):6067-78. PubMed ID: 22450696 [TBL] [Abstract][Full Text] [Related]
24. DFT/TDDFT exploration of the potential energy surfaces of the ground state and excited states of Fe2(S2C3H6)(CO)6: a simple functional model of the [FeFe] hydrogenase active site. Bertini L; Greco C; De Gioia L; Fantucci P J Phys Chem A; 2009 May; 113(19):5657-70. PubMed ID: 19378958 [TBL] [Abstract][Full Text] [Related]
25. 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]
26. 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]
27. State-to-state vacuum ultraviolet photodissociation study of CO2 on the formation of state-correlated CO(X(1)Σ(+); v) with O((1)D) and O((1)S) photoproducts at 11.95-12.22 eV. Lu Z; Chang YC; Benitez Y; Luo Z; Houria AB; Ayari T; Al Mogren MM; Hochlaf M; Jackson WM; Ng CY Phys Chem Chem Phys; 2015 May; 17(17):11752-62. PubMed ID: 25868654 [TBL] [Abstract][Full Text] [Related]
28. Roaming is the dominant mechanism for molecular products in acetaldehyde photodissociation. Heazlewood BR; Jordan MJ; Kable SH; Selby TM; Osborn DL; Shepler BC; Braams BJ; Bowman JM Proc Natl Acad Sci U S A; 2008 Sep; 105(35):12719-24. PubMed ID: 18687891 [TBL] [Abstract][Full Text] [Related]
30. State-to-state photodissociation dynamics of H2O in the B-band: competition between two coexisting nonadiabatic pathways. Zhou L; Jiang B; Xie D; Guo H J Phys Chem A; 2013 Aug; 117(32):6940-7. PubMed ID: 23210666 [TBL] [Abstract][Full Text] [Related]
31. Theoretical insight into the wavelength-dependent photodissociation mechanism of nitric acid. Xiao H; Maeda S; Morokuma K Phys Chem Chem Phys; 2016 Sep; 18(35):24582-90. PubMed ID: 27538805 [TBL] [Abstract][Full Text] [Related]
32. Visible/Infrared Dissociation of NO3: Roaming in the Dark or Roaming on the Ground? Fernando R; Dey A; Broderick BM; Fu B; Homayoon Z; Bowman JM; Suits AG J Phys Chem A; 2015 Jul; 119(28):7163-8. PubMed ID: 25407947 [TBL] [Abstract][Full Text] [Related]
33. Solvent-mediated electron hopping: long-range charge transfer in IBr-(CO2) photodissociation. Sheps L; Miller EM; Horvath S; Thompson MA; Parson R; McCoy AB; Lineberger WC Science; 2010 Apr; 328(5975):220-4. PubMed ID: 20203015 [TBL] [Abstract][Full Text] [Related]
34. Nonadiabatic effects in C-Br bond scission in the photodissociation of bromoacetyl chloride. Valero R; Truhlar DG J Chem Phys; 2006 Nov; 125(19):194305. PubMed ID: 17129101 [TBL] [Abstract][Full Text] [Related]
35. A full-dimensional coupled-surface study of the photodissociation dynamics of ammonia using the multiconfiguration time-dependent Hartree method. Giri K; Chapman E; Sanz CS; Worth G J Chem Phys; 2011 Jul; 135(4):044311. PubMed ID: 21806123 [TBL] [Abstract][Full Text] [Related]
36. Electron wavepacket dynamics in highly quasi-degenerate coupled electronic states: a theory for chemistry where the notion of adiabatic potential energy surface loses the sense. Yonehara T; Takatsuka K J Chem Phys; 2012 Dec; 137(22):22A520. PubMed ID: 23249057 [TBL] [Abstract][Full Text] [Related]
37. Systematic exploration of the mechanism of chemical reactions: the global reaction route mapping (GRRM) strategy using the ADDF and AFIR methods. Maeda S; Ohno K; Morokuma K Phys Chem Chem Phys; 2013 Mar; 15(11):3683-701. PubMed ID: 23389653 [TBL] [Abstract][Full Text] [Related]
38. Photodissociation dynamics of D2O via the B̃(1A1) electronic state. Cheng Y; Cheng L; Guo Q; Yuan K; Dai D; Yang X J Chem Phys; 2011 Mar; 134(10):104305. PubMed ID: 21405163 [TBL] [Abstract][Full Text] [Related]
39. Automated global mapping of minimal energy points on seams of crossing by the anharmonic downward distortion following method: a case study of H2CO. Maeda S; Ohno K; Morokuma K J Phys Chem A; 2009 Mar; 113(9):1704-10. PubMed ID: 19183041 [TBL] [Abstract][Full Text] [Related]
40. Dynamics of electronic states and spin-flip for photodissociation of dihalogens in matrices: experiment and semiclassical surface-hopping and quantum model simulations for F2 and ClF in solid Ar. Bargheer M; Cohen A; Gerber RB; Gühr M; Korolkov MV; Manz J; Niv MY; Schröder M; Schwentner N J Phys Chem A; 2007 Sep; 111(38):9573-85. PubMed ID: 17629252 [TBL] [Abstract][Full Text] [Related] [Previous] [Next] [New Search]