Site-Selective Isomerization of Cyano-Substituted Butadienes: Chemical Control of Nonadiabatic Dynamics (Unknown)
- New search for: MacDonell, Ryan J.
- New search for: Schuurman, Michael S.
- Further information on Schuurman, Michael S.:
- https://orcid.org/0000-0002-0922-9034
- New search for: MacDonell, Ryan J.
- New search for: Schuurman, Michael S.
- Further information on Schuurman, Michael S.:
- https://orcid.org/0000-0002-0922-9034
In:
The Journal of Physical Chemistry A
;
123
, 22
;
4693-4701
;
2019
- Article (Journal) / Electronic Resource
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Title:Site-Selective Isomerization of Cyano-Substituted Butadienes: Chemical Control of Nonadiabatic Dynamics
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Additional title:J. Phys. Chem. A
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Contributors:MacDonell, Ryan J. ( author ) / Schuurman, Michael S. ( author )
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Published in:The Journal of Physical Chemistry A ; 123, 22 ; 4693-4701
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Publisher:
- New search for: American Chemical Society
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Publication date:2019-06-06
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ISSN:
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Coden:
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DOI:
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Type of media:Article (Journal)
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Type of material:Electronic Resource
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Language:Unknown
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Source:
Table of contents – Volume 123, Issue 22
The tables of contents are generated automatically and are based on the data records of the individual contributions available in the index of the TIB portal. The display of the Tables of Contents may therefore be incomplete.
- 4639
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New Developments in Semiclassical Transition-State TheoryShan, Xiao / Burd, Timothy A. H. / Clary, David C. et al. | 2019
- 4658
-
Exploring Amyloid‑β Dimer Structure Using Molecular Dynamics SimulationsMehrazma, Banafsheh / Rauk, Arvi et al. | 2019
- 4671
-
Gas-Phase Reaction between CF2O and CF3C(O)OH: Characterization of CF3C(O)OC(O)FBerasategui, Matias / Argüello, Gustavo A. / Burgos Paci, Maxi A. et al. | 2019
- 4679
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Large Intermediates in Hydrazine Decomposition: A Theoretical Study of the N3H5 and N4H6 Potential Energy SurfacesGrinberg Dana, Alon / Moore, Kevin B. / Jasper, Ahren W. / Green, William H. et al. | 2019
- 4693
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Site-Selective Isomerization of Cyano-Substituted Butadienes: Chemical Control of Nonadiabatic DynamicsMacDonell, Ryan J. / Schuurman, Michael S. et al. | 2019
- 4702
-
Controlling Electron Dynamics with Carrier-Envelope Phases of a Laser PulseDey, Diptesh / Ray, Dhiman / Tiwari, Ashwani K. et al. | 2019
- 4708
-
S1/S0 Potential Energy Surfaces Experience Different Types of Restricted Rotation: Restricted Z/E Photoisomerization and E/Z Thermoisomerization by an Out-of-Plane Benzyl Group or In-Plane m‑Pyridinium Group?Xu, Jun-Jia / Sung, Robert / Sung, Kuangsen et al. | 2019
- 4717
-
Photophysics of Acyl- and Ester-DBD Dyes: Quadrupole-Induced Solvent Relaxation Investigated by Transient Absorption SpectroscopyHaubitz, Toni / John, Leonard / Wessig, Pablo / Kumke, Michael U. et al. | 2019
- 4727
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Effects of Naphthyl Connectivity on the Photophysics of Compact Organic Charge-Transfer Photoredox CatalystsSartor, Steven M. / Lattke, Yisrael M. / McCarthy, Blaine G. / Miyake, Garret M. / Damrauer, Niels H. et al. | 2019
- 4737
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Size-Dependent Relaxation Processes of Photoexcited [n]Cycloparaphenylenes (n = 5–12): Significant Contribution of Internal Conversion in Smaller RingsFujitsuka, Mamoru / Lu, Chao / Zhuang, Bo / Kayahara, Eiichi / Yamago, Shigeru / Majima, Tetsuro et al. | 2019
- 4743
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Activation of CO2 in Photoirradiated CO2–H2O Clusters: Direct Ab Initio Molecular Dynamics (MD) StudyTachikawa, Hiroto et al. | 2019
- 4750
-
Infrared Spectra of the 1‑Methylvinoxide Radical and Anion Isolated in Solid ArgonLin, Meng-Yeh / Huang, Tzu-Ping / Wu, Pei-Zhen / Chin, Chih-Hao / Wu, Yu-Jong et al. | 2019
- 4755
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Variationally Computed IR Line List for the Methyl Radical CH3Adam, Ahmad Y. / Yachmenev, Andrey / Yurchenko, Sergei N. / Jensen, Per et al. | 2019
- 4764
-
Theoretical Calculation of Reaction Rates and Combustion Kinetic Modeling Study of Triethyl Phosphate (TEP)Neupane, Sneha / Rahman, Ramees K. / Masunov, Artëm E. / Vasu, Subith S. et al. | 2019
- 4776
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Molecular Dynamics of Combustion Reactions in Supercritical Carbon Dioxide. Part 5: Computational Study of Ethane Dissociation and Recombination Reactions C2H6 ⇌ CH3 + CH3Wang, Chun-Hung / Panteleev, Sergey V. / Masunov, Artëm E. / Allison, Timothy C. / Chang, Sungho / Lim, Chansun / Jin, Yuin / Vasu, Subith S. et al. | 2019
- 4785
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Domain Separation in Density Functional TheoryMosquera, Martín A. / Jones, Leighton O. / Borca, Carlos H. / Ratner, Mark A. / Schatz, George C. et al. | 2019
- 4796
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Performance of ACE-Reaction on 26 Organic Reactions for Fully Automated Reaction Network Construction and Microkinetic AnalysisKim, Jin Woo / Kim, Yeonjoon / Baek, Kyung Yup / Lee, Kyunghoon / Kim, Woo Youn et al. | 2019
- 4806
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On the Models for the Investigation of Charged Defects in Solids: The Case of the VN– Defect in DiamondDovesi, Roberto / Gentile, Francesco Silvio / Ferrari, Anna Maria / Pascale, Fabien / Salustro, Simone / D’Arco, Philippe et al. | 2019