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Jianwei Wang, Ph.D - Publications

Affiliations: 
2013- Geology & Geophysics Louisiana State University Baton Rouge 
Area:
Geochemistry, Molecular Modeling
Website:
https://www.lsu.edu/science/geology/
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26 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 Wang J, Ghosh DB, Zhang Z. Computational Materials Design for Ceramic Nuclear Waste Forms Using Machine Learning, First-Principles Calculations, and Kinetics Rate Theory. Materials (Basel, Switzerland). 16. PMID 37512262 DOI: 10.3390/ma16144985  0.61
2020 Yang K, Zhu W, Scott S, Wang Y, Wang J, Riley BJ, Vienna J, Lian J. Immobilization of cesium and iodine into CsBiI perovskite-silica composites and core-shell waste forms with high waste loadings and chemical durability. Journal of Hazardous Materials. 401: 123279. PMID 32629351 DOI: 10.1016/J.Jhazmat.2020.123279  0.306
2020 Zhang Z, Liu H, Wang J. Energetics of Interfacial Interactions of Hydrocarbon Fluids with Kerogen and Calcite Using Molecular Modeling Energy & Fuels. 34: 4251-4259. DOI: 10.1021/Acs.Energyfuels.0C00053  0.629
2019 Zhang Z, Gustin L, Xie W, Lian J, Valsaraj KT, Wang J. Effect of solution chemistry on the iodine release from iodoapatite in aqueous environments Journal of Nuclear Materials. 525: 161-170. DOI: 10.1016/J.Jnucmat.2019.07.034  0.659
2018 Zhang Z, Heath A, Valsaraj KT, Ebert W, Yao T, Lian J, Wang J. Mechanism of iodine release from iodoapatite in aqueous solution Rsc Advances. 8: 3951-3957. DOI: 10.1039/C7Ra11049A  0.623
2017 He Y, Cao X, Wang J, Bao H. Identifying apparent local stable isotope equilibrium in a complex non-equilibrium system. Rapid Communications in Mass Spectrometry : Rcm. PMID 29205593 DOI: 10.1002/Rcm.8040  0.643
2017 Yao G, Zhang Z, Wang J. Beta transmutations in apatites with ferric iron as an electron acceptor - implication for nuclear waste form development. Physical Chemistry Chemical Physics : Pccp. PMID 28900637 DOI: 10.1039/C7Cp02846F  0.651
2014 Yi L, Liang D, Zhou X, Li D, Wang J. Molecular dynamics simulations of carbon dioxide hydrate growth in electrolyte solutions of NaCl and MgCl2 Molecular Physics. 112: 3127-3137. DOI: 10.1080/00268976.2014.932454  0.309
2014 Wang J, Zhang F, Zhang J, Ewing RC, Becker U, Cai Z. Carbonate orientational order and superlattice structure in vaterite Journal of Crystal Growth. 407: 78-86. DOI: 10.1016/J.Jcrysgro.2014.08.028  0.308
2013 Wang J, Lang M, Ewing RC, Becker U. Multi-scale simulation of structural heterogeneity of swift-heavy ion tracks in complex oxides. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 25: 135001. PMID 23455695 DOI: 10.1088/0953-8984/25/13/135001  0.305
2013 Wang J, Ewing RC, Becker U. Electronic structure and stability of hyperstoichiometric UO2+x under pressure Physical Review B - Condensed Matter and Materials Physics. 88. DOI: 10.1103/Physrevb.88.024109  0.315
2011 Wang J, Rak Z, Zhang F, Ewing RC, Becker U. Electronic structure and energetics of tetragonal SrCuO₂ and its high-pressure superstructure phase. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 23: 465503. PMID 22056857 DOI: 10.1088/0953-8984/23/46/465503  0.312
2010 Wang J, Lu H, Ripmeester JA, Becker U. Molecular-Dynamics and First-Principles Calculations of Raman Spectra and Molecular and Electronic Structure of Hydrogen Clusters in Hydrogen Clathrate Hydrate The Journal of Physical Chemistry C. 114: 21042-21050. DOI: 10.1021/Jp106788U  0.335
2009 Wang J, Becker U. Structure and carbonate orientation of vaterite (CaCO3) American Mineralogist. 94: 380-386. DOI: 10.2138/Am.2009.2939  0.316
2009 Wang J, Kalinichev AG, Kirkpatrick RJ. Asymmetrie hydrogen bonding and orientational ordering of water at hydrophobic and hydrophilic surfaces: A comparison of water/vapor, water/talc, and water/mica interfaces Journal of Physical Chemistry C. 113: 11077-11085. DOI: 10.1021/Jp9018316  0.615
2007 Wang J, Rustad JR, Casey WH. Calculation of water-exchange rates on aqueous polynuclear clusters and at oxide-water interfaces. Inorganic Chemistry. 46: 2962-4. PMID 17355130 DOI: 10.1021/Ic070079+  0.339
2007 Kalinichev AG, Wang J, Kirkpatrick RJ. Molecular dynamics modeling of the structure, dynamics and energetics of mineral–water interfaces: Application to cement materials Cement and Concrete Research. 37: 337-347. DOI: 10.1016/J.Cemconres.2006.07.004  0.617
2006 Wang J, Rustad JR. A Simple Model for the Effect of Hydration on the Distribution of Ferrous Iron at Reduced Hematite (012) Surfaces Geochimica Et Cosmochimica Acta. 70: 5285-5292. DOI: 10.1016/J.Gca.2006.08.022  0.309
2006 Wang J, Kalinichev AG, Kirkpatrick RJ. Effects of substrate structure and composition on the structure, dynamics, and energetics of water at mineral surfaces: A molecular dynamics modeling study Geochimica Et Cosmochimica Acta. 70: 562-582. DOI: 10.1016/J.Gca.2005.10.006  0.622
2005 Wang J, Kalinichev AG, Kirkpatrick RJ, Cygan RT. Structure, energetics, and dynamics of water adsorbed on the muscovite (001) surface: a molecular dynamics simulation. The Journal of Physical Chemistry. B. 109: 15893-905. PMID 16853018 DOI: 10.1021/Jp045299C  0.624
2005 Wang J, Kalinichev AG, Kirkpatrick RJ. Structure and decompression melting of a novel, high-pressure nanoconfined 2-D ice. The Journal of Physical Chemistry. B. 109: 14308-13. PMID 16852798 DOI: 10.1021/Jp045297S  0.611
2005 Kirkpatrick RJ, Kalinichev AG, Wang J. Molecular dynamics modelling of hydrated mineral interlayers and surfaces : structure and dynamics Mineralogical Magazine. 69: 289-308. DOI: 10.1180/0026461056930251  0.625
2004 Wang J, Kalinichev AG, Kirkpatrick RJ. Molecular modeling of water structure in nano-pores between brucite (001) surfaces Geochimica Et Cosmochimica Acta. 68: 3351-3365. DOI: 10.1016/J.Gca.2004.02.016  0.629
2004 Wang J, Kalinichev AG, Kirkpatrick RJ. Molecular modeling of the 10-Å phase at subduction zone conditions Earth and Planetary Science Letters. 222: 517-527. DOI: 10.1016/J.Epsl.2004.03.013  0.605
2003 Wang J, Kalinichev AG, Amonette JE, Kirkpatrick RJ. Interlayer structure and dynamics of Cl-bearing hydrotalcite: far infrared spectroscopy and molecular dynamics modeling American Mineralogist. 88: 398-409. DOI: 10.2138/Am-2003-2-316  0.588
2001 Wang J, Kalinichev AG, Kirkpatrick RJ, Hou X. Molecular Modeling of the Structure and Energetics of Hydrotalcite Hydration Chemistry of Materials. 13: 145-150. DOI: 10.1021/Cm000441H  0.616
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