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Zongtang Fang - Publications

Affiliations: 
Chemistry The University of Alabama, Tuscaloosa, AL 
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36 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2023 Hu Y, Fang Z, Vasiliu M, Dixon DA. Computational Study of Dehydration and Dehydrogenation of Ethanol on (TiO) ( = 2-4) Nanoclusters. The Journal of Physical Chemistry. A. PMID 37043178 DOI: 10.1021/acs.jpca.3c00776  0.637
2021 Persaud RR, Fang Z, Zall CM, Appel AM, Dixon DA. Computational Study of Triphosphine-Ligated Cu(I) Catalysts for Hydrogenation of CO to Formate. The Journal of Physical Chemistry. A. PMID 34297558 DOI: 10.1021/acs.jpca.1c04050  0.445
2021 Fang Z, Confer MP, Wang Y, Wang Q, Kunz MR, Dufek EJ, Liaw B, Klein TM, Dixon DA, Fushimi R. Formation of Surface Impurities on Lithium-Nickel-Manganese-Cobalt Oxides in the Presence of CO and HO. Journal of the American Chemical Society. PMID 34213895 DOI: 10.1021/jacs.1c03812  0.389
2019 Fang Z, Vasiliu M, Chen X, Gong Y, Andrews L, Dixon DA. Formation of Cerium and Neodymium Isocyanides in the Reactions of Cyanogen with Ce and Nd Atoms in Argon Matrices. The Journal of Physical Chemistry. A. PMID 31441657 DOI: 10.1021/Acs.Jpca.9B06026  0.717
2019 Wei R, Fang Z, Vasiliu M, Dixon DA, Andrews L, Gong Y. Infrared Spectroscopic and Theoretical Studies of the 3d Transition Metal Oxyfluoride Molecules. Inorganic Chemistry. PMID 31306010 DOI: 10.1021/Acs.Inorgchem.9B00822  0.704
2018 Andrews L, Cho HG, Fang Z, Vasiliu M, Dixon DA. Tungsten Hydride Phosphorus- and Arsenic-Bearing Molecules with Double and Triple W-P and W-As Bonds. Inorganic Chemistry. PMID 29658705 DOI: 10.1021/Acs.Inorgchem.8B00348  0.677
2018 Fang Z, Vasiliu M, Peterson KA, Dixon DA. Computational Study of Molecular Hydrogen Adsorption over Small (MO) Nanoclusters (M = Ti, Zr, Hf; n = 1 to 4). The Journal of Physical Chemistry. A. PMID 29634266 DOI: 10.1021/Acs.Jpca.7B12634  0.703
2017 Fang Z, Garner EB, Dixon DA, Gong Y, Andrews L, Liebov BK. Laser-Ablated U Atom Reactions with (CN)2 to Form UNC, U(NC)2, and U(NC)4: Matrix Infrared Spectra and Quantum Chemical Calculations. The Journal of Physical Chemistry. A. PMID 29261311 DOI: 10.1021/Acs.Jpca.7B09291  0.506
2017 Wei R, Li Q, Gong Y, Andrews L, Fang Z, Thanthiriwatte KS, Vasiliu M, Dixon DA. Infrared Spectroscopic and Theoretical Studies on the OMF2 and OMF (M=Cr, Mo, W) Molecules in Solid Argon. The Journal of Physical Chemistry. A. PMID 28926255 DOI: 10.1021/Acs.Jpca.7B08088  0.69
2017 Fang Z, Outlaw MA, Dixon DA. Electronic Structures of Small (RuO2)n (n= 1 to 4) Nanoclusters and Their Anions and the Hydrolysis Reactions with Water. The Journal of Physical Chemistry. A. PMID 28898583 DOI: 10.1021/Acs.Jpca.7B07226  0.561
2017 Chen X, Li Q, Gong Y, Andrews L, Liebov BK, Fang Z, Dixon DA. Formation and Characterization of Homoleptic Thorium Isocyanide Complexes. Inorganic Chemistry. PMID 28421751 DOI: 10.1021/Acs.Inorgchem.7B00196  0.514
2017 Wang X, Andrews L, Fang Z, Thanthiriwatte KS, Chen M, Dixon DA. Properties of Lanthanide Hydroxide Molecules Produced in Reactions of Lanthanide Atoms with H2O2 and H2 + O2 Mixtures: Roles of the +I, +II, +III and +IV Oxidation States. The Journal of Physical Chemistry. A. PMID 28095696 DOI: 10.1021/Acs.Jpca.6B12607  0.771
2017 Fang Z, Vasiliu M, Peterson KA, Dixon DA. Prediction of Bond Dissociation Energies/Heat of Formation for Diatomic Transition metal Compounds: CCSD(T) Works. Journal of Chemical Theory and Computation. PMID 28080051 DOI: 10.1021/Acs.Jctc.6B00971  0.678
2016 Fang Z, Lee Z, Peterson KA, Dixon DA. Use of Improved Orbitals for CCSD(T) Calculations for Predicting Heats of Formation of Group IV and Group VI Metal Oxide Monomers and Dimers and UCl6. Journal of Chemical Theory and Computation. PMID 27398941 DOI: 10.1021/Acs.Jctc.6B00327  0.543
2016 Fang Z, Both J, Li S, Yue S, Aprà E, Keçeli M, Wagner AF, Dixon DA. Benchmark Calculations of Energetic Properties of Groups 4 and 6 Transition Metal Oxide Nanoclusters Including Comparison to Density Functional Theory. Journal of Chemical Theory and Computation. PMID 27384926 DOI: 10.1021/Acs.Jctc.6B00464  0.644
2016 Finney B, Fang Z, Francisco JS, Dixon DA. Energetic Properties and Electronic Structure of [Si,N,S] and [Si,P,S] Isomers. The Journal of Physical Chemistry. A. PMID 26914520 DOI: 10.1021/Acs.Jpca.6B00918  0.545
2016 Fang Z, Zetterholm P, Dixon DA. 1,2-Ethanediol and 1,3-Propanediol Conversions over (MO3)3 (M=Mo, W) Nanoclusters: A Computational Study. The Journal of Physical Chemistry. A. PMID 26901665 DOI: 10.1021/Acs.Jpca.6B00158  0.571
2016 Fang Z, Thanthiriwatte KS, Dixon DA, Andrews L, Wang X. Properties of Cerium Hydroxides from Matrix Infrared Spectra and Electronic Structure Calculations. Inorganic Chemistry. PMID 26814626 DOI: 10.1021/Acs.Inorgchem.5B02619  0.569
2016 Vent-Schmidt T, Fang Z, Lee Z, Dixon D, Riedel S. Extending the Row of Lanthanide Tetrafluorides: A Combined Matrix-Isolation and Quantum-Chemical Study. Chemistry (Weinheim An Der Bergstrasse, Germany). 22: 2406-16. PMID 26786900 DOI: 10.1002/Chem.201504182  0.55
2016 Mikulas TC, Chen M, Fang Z, Peterson KA, Andrews L, Dixon DA. Structures and Properties of the Products of the Reaction of Lanthanide Atoms with H2O: Dominance of the +II Oxidation State. The Journal of Physical Chemistry. A. PMID 26741150 DOI: 10.1021/Acs.Jpca.5B11215  0.729
2016 Chen M, Straatsma TP, Fang Z, Dixon DA. Structural and electronic property study of (ZnO)n, n ≤ 168: Transition from zinc oxide molecular clusters to ultrasmall nanoparticles Journal of Physical Chemistry C. 120: 20400-20418. DOI: 10.1021/Acs.Jpcc.6B06730  0.496
2016 Laminack W, Gole JL, White MG, Ozdemir S, Ogden AG, Martin HJ, Fang Z, Wang TH, Dixon DA. Synthesis of nanoscale silicon oxide oxidation state distributions: The transformation from hydrophilicity to hydrophobicity Chemical Physics Letters. 653: 137-143. DOI: 10.1016/J.Cplett.2016.04.079  0.759
2015 Haiges R, Skotnitzki J, Fang Z, Dixon DA, Christe KO. The Molybdenum(V) and Tungsten(VI) Oxoazides [MoO(N3 )3 ], [MoO(N3 )3 ⋅2 CH3 CN], [(bipy)MoO(N3 )3 ], [MoO(N3 )5 ](2-) , [WO(N3 )4 ], and [WO(N3 )4 ⋅CH3 CN]. Angewandte Chemie (International Ed. in English). 54: 15550-5. PMID 26768534 DOI: 10.1002/Anie.201505418  0.466
2015 Haiges R, Skotnitzki J, Fang Z, Dixon DA, Christe KO. The First Molybdenum(VI) and Tungsten(VI) Oxoazides MO2(N3)2, MO2(N3)2⋅2 CH3CN, (bipy)MO2(N3)2, and [MO2(N3)4](2-) (M=Mo, W). Angewandte Chemie (International Ed. in English). 54: 9581-5. PMID 26178877 DOI: 10.1002/Anie.201504629  0.479
2015 Gong Y, Andrews L, Liebov BK, Fang Z, Garner EB, Dixon DA. Reactions of laser-ablated U atoms with (CN)2: infrared spectra and electronic structure calculations of UNC, U(NC)2, and U(NC)4 in solid argon. Chemical Communications (Cambridge, England). 51: 3899-902. PMID 25656733 DOI: 10.1039/C4Cc09946J  0.502
2015 Fang Z, Wang Y, Dixon DA. Computational Study of Ethanol Conversion on Al8O12 as a Model for γ-Al2O3 Journal of Physical Chemistry C. 119: 23413-23421. DOI: 10.1021/Acs.Jpcc.5B05887  0.51
2015 Haiges R, Skotnitzki J, Fang Z, Dixon DA, Christe KO. The First Molybdenum(VI) and Tungsten(VI) Oxoazides MO2(N3)2, MO2(N3)2•2CH3CN, (bipy)MO2(N3)2, and [MO2(N3)4]2- (M=Mo, W) Angewandte Chemie - International Edition. 54: 9581-9585. DOI: 10.1002/anie.201504629  0.367
2015 Haiges R, Skotnitzki J, Fang Z, Dixon DA, Christe KO. Die Molybdän(V)- und Wolfram(VI)-oxoazide [MoO(N3)3], [MoO(N3)3⋅2 CH3CN], [(bipy)MoO(N3)3], [MoO(N3)5]2−, [WO(N3)4] und [WO(N3)4⋅CH3CN] Angewandte Chemie. 127: 15771-15776. DOI: 10.1002/Ange.201505418  0.424
2014 Fang Z, Li Z, Kelley MS, Kay BD, Li S, Hennigan JM, Rousseau R, Dohnálek Z, Dixon DA. Oxidation, reduction, and condensation of alcohols over (MO3)3 (M = Mo, W) nanoclusters Journal of Physical Chemistry C. 118: 22620-22634. DOI: 10.1021/Jp5072132  0.523
2014 Li Z, Fang Z, Kelley MS, Kay BD, Rousseau R, Dohnalek Z, Dixon DA. Ethanol conversion on cyclic (MO3)3 (M = Mo, W) clusters Journal of Physical Chemistry C. 118: 4869-4877. DOI: 10.1021/Jp500255F  0.486
2013 Fang Z, Dixon DA. Computational study of H2 and O2 production from water splitting by small (MO2)n clusters (M = Ti, Zr, Hf). The Journal of Physical Chemistry. A. 117: 3539-55. PMID 23544659 DOI: 10.1021/Jp401443X  0.582
2013 Fang Z, Dixon DA. Hydrolysis of ZrCl4 and HfCl4: The initial steps in the high-temperature oxidation of metal chlorides to produce ZrO2 and HfO2 Journal of Physical Chemistry C. 117: 7459-7474. DOI: 10.1021/Jp400228D  0.54
2012 Fang Z, Outlaw MD, Smith KK, Gist NW, Li S, Dixon DA, Gole JL. Computational study of the hydrolysis reactions of small MO 2 (M = Zr and Hf) nanoclusters with water Journal of Physical Chemistry C. 116: 8475-8492. DOI: 10.1021/Jp210867W  0.691
2012 Mikulas T, Fang Z, Gole JL, White MG, Dixon DA. The presence of Ti(II) centers in doped nanoscale TiO 2 and TiO 2-xN x Chemical Physics Letters. 539: 58-63. DOI: 10.1016/J.Cplett.2012.04.010  0.713
2011 Wang TH, Fang Z, Gist NW, Li S, Dixon DA, Gole JL. Computational study of the hydrolysis reactions of the ground and first excited triplet states of small TiO2 nanoclusters Journal of Physical Chemistry C. 115: 9344-9360. DOI: 10.1021/Jp111026X  0.771
2011 Wang TH, Gole JL, White MG, Watkins C, Street SC, Fang Z, Dixon DA. The surprising oxidation state of fumed silica and the nature of water binding to silicon oxides and hydroxides Chemical Physics Letters. 501: 159-165. DOI: 10.1016/J.Cplett.2010.11.013  0.761
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