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Dawes, Richard, Lolur, Phalgun, Li, Anyang, Jiang, Bin, Guo, Hua (2013) Communication: An accurate global potential energy surface for the ground electronic state of ozone. The Journal of Chemical Physics, 139 (20). 201103pp. doi:10.1063/1.4837175

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Reference TypeJournal (article/letter/editorial)
TitleCommunication: An accurate global potential energy surface for the ground electronic state of ozone
JournalThe Journal of Chemical Physics
AuthorsDawes, RichardAuthor
Lolur, PhalgunAuthor
Li, AnyangAuthor
Jiang, BinAuthor
Guo, HuaAuthor
Year2013 (November 28)Volume139
Issue20
PublisherAIP Publishing
DOIdoi:10.1063/1.4837175Search in ResearchGate
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Mindat Ref. ID2364390Long-form Identifiermindat:1:5:2364390:5
GUID0
Full ReferenceDawes, Richard, Lolur, Phalgun, Li, Anyang, Jiang, Bin, Guo, Hua (2013) Communication: An accurate global potential energy surface for the ground electronic state of ozone. The Journal of Chemical Physics, 139 (20). 201103pp. doi:10.1063/1.4837175
Plain TextDawes, Richard, Lolur, Phalgun, Li, Anyang, Jiang, Bin, Guo, Hua (2013) Communication: An accurate global potential energy surface for the ground electronic state of ozone. The Journal of Chemical Physics, 139 (20). 201103pp. doi:10.1063/1.4837175
In(2013, November) The Journal of Chemical Physics Vol. 139 (20) AIP Publishing

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Dawes, Richard, Lolur, Phalgun, Ma, Jianyi, Guo, Hua (2011) Communication: Highly accurate ozone formation potential and implications for kinetics. The Journal of Chemical Physics, 135 (8). 81102pp. doi:10.1063/1.3632055
Li, Jun, Wang, Yimin, Jiang, Bin, Ma, Jianyi, Dawes, Richard, Xie, Daiqian, Bowman, Joel M., Guo, Hua (2012) Communication: A chemically accurate global potential energy surface for the HO + CO → H + CO2 reaction. The Journal of Chemical Physics, 136 (4). 41103pp. doi:10.1063/1.3680256
Li, Jun, Dawes, Richard, Guo, Hua (2013) Kinetic and dynamic studies of the Cl(2Pu) + H2O(X̃1A1) → HCl(X̃1Σ+) + OH(X̃2Π) reaction on an ab initio based full-dimensional global potential energy surface of the ground electronic state of ClH2O. The Journal of Chemical Physics, 139 (7). 74302pp. doi:10.1063/1.4817967
Lolur, Phalgun, Dawes, Richard (2014) 3D Printing of Molecular Potential Energy Surface Models. Journal of Chemical Education, 91. 1181-1184 doi:10.1021/ed500199m
Li, Anyang, Xie, Daiqian, Dawes, Richard, Jasper, Ahren W., Ma, Jianyi, Guo, Hua (2010) Global potential energy surface, vibrational spectrum, and reaction dynamics of the first excited (Ã A2′) state of HO2. The Journal of Chemical Physics, 133 (14). 144306pp. doi:10.1063/1.3490642
Li, Jun, Dawes, Richard, Guo, Hua (2016) An accurate multi-channel multi-reference full-dimensional global potential energy surface for the lowest triplet state of H2O2. Physical Chemistry Chemical Physics, 18 (43). 29825-29835 doi:10.1039/c6cp06232f
Han, Huixian, Li, Anyang, Guo, Hua (2014) Toward spectroscopically accurate global ab initio potential energy surface for the acetylene-vinylidene isomerization. The Journal of Chemical Physics, 141 (24). 244312pp. doi:10.1063/1.4904859
Li, Yaqin, Sun, Zhigang, Jiang, Bin, Xie, Daiqian, Dawes, Richard, Guo, Hua (2014) Communication: Rigorous quantum dynamics of O + O2 exchange reactions on an ab initio potential energy surface substantiate the negative temperature dependence of rate coefficients. The Journal of Chemical Physics, 141 (8). 81102pp. doi:10.1063/1.4894069
Nyambo, Silver, Karshenas, Cyrus, Reid, Scott A., Lolur, Phalgun, Dawes, Richard (2015) Towards a global model of spin-orbit coupling in the halocarbenes. The Journal of Chemical Physics, 142 (21). 214304pp. doi:10.1063/1.4921466
Li, Jun, Dawes, Richard, Guo, Hua (2012) An ab initio based full-dimensional global potential energy surface for FH2O(X2A′) and dynamics for the F + H2O → HF + HO reaction. The Journal of Chemical Physics, 137 (9). 94304pp. doi:10.1063/1.4748857
Xie, Daiqian, Guo, Hua, Peterson, Kirk A. (2000) Accurate ab initio near-equilibrium potential energy and dipole moment functions of the ground electronic state of ozone. The Journal of Chemical Physics, 112 (19). 8378-8386 doi:10.1063/1.481442
 
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