Peer-reviewed publications of research supported in part or in whole under an EFRC are listed below. Publications are ordered first by year, then alphabetically by EFRC acronym, and finally alphabetically by first author. Links to the DOI and associated EFRC appear at the end of each citation. The publication list is updated periodically; the last such update was June 30, 2015.

1401.Neuhauser, Daniel; Gao, Yi; Arntsen, Christopher; Karshenas, Cyrus; Rabani, Eran; and Baer, Roi  Breaking the Theoretical Scaling Limit for Predicting Quasiparticle Energies The Stochastic GW Approach  Phys Rev Lett, 113, 076402 (2014).  [DOI: 10.1103/PhysRevLett.113.076402External link] [MEEM]
1402.Pilon, Laurent; and d'Entremont, Anna  First Principles Thermal Modeling of Electric Double Layer Capacitors Under Constant-Current Cycling  Journal of Power Sources, 246, 887-898 (2014).  [DOI: 10.1016/j.jpowsour.2013.08.024External link] [MEEM]
1403.Ray, Keith G.; Olmsted, David; Burton, Jessica M.R.; Houndonougbo, Yao; Laird, Brian B.; and Asta, Mark  Gas Membrane Selectivity Enabled by Zeolitic Imidazolate Framework Electrostatics  Chemistry of Materials, 26, 3976−3985 (2014).  [DOI: 10.1021/cm5015477External link] [MEEM]
1404.Simon, Patrice; Gogotsi, Yury; and Dunn, Bruce  Where Do Batteries End and Supercapacitors Begin?  Science, 343, 1210 (2014).  [DOI: 10.1126/science.1249625External link] [MEEM]
1405.Street, R. A.; Hawks, Steven A; Khlyabich, Petr P.; Li, Gang; Schwartz, Benjamin J.; Thompson, Barry C.; and Yang, Yang  The Electronic Structure and Transition Energies in Polymer-Fullerene Bulk Heterojunctions  J Phys Chem C, , (2014).  [DOI: 10.1021/jp507097hExternal link] [MEEM]
1406.Wang, Zhenging; Yang, Yang; Olmsted, David; Asta, Mark; and Laird, Brian B.  Evaluation of the constant potential method in simulating electric double-layer capacitors  Journal of Chemical Physics, 141, 184102 (2014).  [DOI: 10.1063/1.4899176External link] [MEEM]
1407.Zhang, Guangye; Huber, Rachel; Ferreira, Amy S; Boyd, Shane D.; Luscombe, Christine K.; Tolbert, Sarah H.; and Schwartz, Benjamin J.  Crystallinity Effects in Sequentially Processed and Blend-Cast Bulk- Heterojunction Polymer/Fullerene Photovoltaics  Journal of Physical Chemistry C, 118, 18424−18435 (2014).  [DOI: 10.1021/jp5054315External link] [MEEM]
1408.Aidhy, Dilpuneet S. ; Zhang, Y.; and Weber, William  A fast grain-growth mechanism revealed in nanocrystalline ceramic-oxides  Scripta Materialia, , (2014).  [DOI: 10.1016/j.scriptamat.2014.03.020External link] [MSA]
1409.Aidhy, Dilpuneet S. ; Zhang, Y.; and Weber, William  Strained ionic interfaces: Effect on oxygen diffusivity from atomistic simulations  J. Physical Chemistry C, 118, 4207-4212 (2014).  [DOI: 10.1021/jp411277qExternal link] [MSA]
1410.Aidhy, Dilpuneet S. ; Zhang, Y.; and Weber, William  Impact of segregation energetics on oxygen conductivity at ionic grain boundaries  J. Materials Chemistry A, 2, 1704-1709 (2014).  [DOI: 10.1039/C3TA14128DExternal link] [MSA]
1411.Alam, T. M.; Liao, Zuolei; Zakhavor, L.N.; and Nyman, May  Solid-state dynamics of uranyl polyoxometalates  Chemistry - A European Journal, 20, 8302-8307 (2014).  [DOI: 10.1002/chem.201402351External link] [MSA]
1412.Alexandrov, V.; Gronbech-Jensen, N.; Navrotsky, A.; and Asta, Mark  Theoretical study of mixing energetics in homovalent fluorite-structured oxide solid solutions  Journal of Nuclear Materials, 444, 292-297 (2014).  [DOI: 10.1016/j.jnucmat.2013.10.001External link] [MSA]
1413.Cantos, P. M.; and Cahill, Christopher L.  A family of UO22+-5-Nitro-1,3-dicarboxylate hybrid materials: Structural variation as a function of pH and structure directing species  CRYSTAL GROWTH & DESIGN, 14, 3044-3053 (2014).  [DOI: 10.1021/cg500304dExternal link] [MSA]
1414.Cantos, P. M.; and Cahill, Christopher L.  Poly[diammonium [diaqua([mu]7-benzene-1,2,3,4,5,6-hexacarboxylato)tetraoxidodiuranium(VI)]]  Acta Crystallographic E: Structural Rep. Online, 70, m142-m143 (2014).  [DOI: 10.1107/S1600536814006047External link] [MSA]
1415.Carter, K. P.; Zulato, C.; and Cahill, Christopher L.  Exploring supramolecular assembly and luminescent behavior in a series of RE-p-chlorobenzoic acid-1,10-phenanthroline complexes  CrystEngComm, 16, 10189 (2014).  [DOI: 10.1039/c4ce01806kExternal link] [MSA]
1416.Carter, K. P.; Pope, S. J.A.; and Cahill, Christopher L.  A series of Ln-p-chlorobenzoic acid-terpyridine complexes: Lanthanide contraction effects, supramolecular interactions and luminescent behavior  CrystEngComm, 16, 1873-1884 (2014).  [DOI: 10.1039/C3CE42267DExternal link] [MSA]
1417.Cross, Justin N; Villa, Eric M.; Darling, Victoria R.; Polinski, Matt J.; Lin, Jian ; Tan, X.; Kikugawa, Naoki N.; Shatruk, J.; Baumbach, Ryan E.; and Albrecht-Schmitt, Thomas E.  Straightforward reductive routes to air-stable uranium (III) and neptunium (III) materials  Inorganic Chemistry, 53, 7455-7466 (2014).  [DOI: 10.1021/ic500771tExternal link] [MSA]
1418.Cross, Justin N; Cary, Samantha K.; Stritzinger, Jared T.; Polinski, Matt J.; and Albrecht-Schmitt, Thomas E.  Synthesis and spectroscopy of new plutonium (III) and -(IV) molybdates: Comparisons of electronic characteristics  Inorganic Chemistry, 53, 3148-3152 (2014).  [DOI: 10.1021/ic403116rExternal link] [MSA]
1419.Eaton, T.; Lin, Jian ; Cross, Justin N; Stritzinger, Jared T.; and Albrecht-Schmitt, Thomas E.  Th(VO3)2(SeO3) and Ln(VO3)2(IO3) (Ln = Ce, Pr, Nd, Sm, and Eu): Unusual cases of aliovalent substitution  Chemical Communications, 50, 3668-3670 (2014).  [DOI: 10.1039/c4cc00537fExternal link] [MSA]
1420.Guo, Xiaofeng; Ushakov, Sergey V.; Labs, S.; Curtius, H.; Bosbach, D.; and Navrotsky, Alex  Energetics of metastudtite and implications for nuclear waste alternative  Proceedings of the National Academy of Sciences, 111, 17737-17742 (2014).  [DOI: 10.1073/pnas.1421144111External link] [MSA]
1421.Guo, Xiaofeng; Rak, Zsolt; Becker, U.; and Navrotsky, Alex  Thermodynamics of thorium substitution in yttrium iron garnet: Comparison of experimental and theoretical results  J. Materials Chemistry A, 2, 16945-16954 (2014).  [DOI: 10.1039/C4TA03683BExternal link] [MSA]
1422.Guo, Z.; Lee, D.; Liu, Yi; Sun, F.; Gau, H.; Burns, Peter C; Huang, L.; and Luo, T.  Tuning the thermal conductivity of solar cell polymers through side chain engineering  Physical Chemistry Chemical Physics, 16, 7764-7771 (2014).  [DOI: 10.1039/C4CP00393DExternal link] [MSA]
1423.Guo, X.; Tavakoli, A.H.; Sutton, S.; Kukkadapu, R.; Qi, L.; Lanzirotti, A.; Newville, M.; Asta, Mark; and Navrotsky, Alex  Cerium substitution in yttrium iron garnet: Valence state, structure, and energetics  Chemistry of Materials, 26, 1133-1143 (2014).  [DOI: 10.1021/cm403444fExternal link] [MSA]
1424.Henline, Kylie; Wang, Charles; Pike, R.D.; Ahern, J.C.; Sousa, B.; Patterson, H.H.; Kerr, A. T.; and Cahill, Christopher L.  Structure, dynamics, and photophysics in the copper (I) iodide-tetrahyrothiophene system  Crystal Growth and Design, 14, 1449-1458 (2014).  [DOI: 10.1021/cg500005pExternal link] [MSA]
1425.Kerr, A. T.; and Cahill, Christopher L.  CuPYDC metalloligands and postsynthetic rearrangement/metalation as routes to bimetallic uranyl containing hybrid materials: Syntheses, structures, and fluorescence  CRYSTAL GROWTH & DESIGN, 14, 4094-4103 (2014).  [DOI: 10.1021/cg5007132External link] [MSA]
1426.Kerr, A. T.; Kumalah, S.A.; Holman, K.T.; Butcher, R.J.; and Cahill, Christopher L.  Uranyl coordination polymers incorporating n5-cyclopentadienyliron-functionalized n6-phthalate metalloligands: Syntheses, structures, and photophysical properties  J. Inorganic Organometallic Polymers, 24, 128-136 (2014).  [DOI: 10.1007/s10904-013-9980-0External link] [MSA]
1427.Kerr, A. T.; and Cahill, Christopher L.  Postsynthetic rearrangement/metalation as a route to bimetallic uranyl coordination polymers: Syntheses, structures, and luminescence  Crystal Growth and Design, 14, 1914-1921 (2014).  [DOI: 10.1021/cg500050qExternal link] [MSA]
1428.Lang, Maik; Toulemonde, M.; Zhang, J. M.; Zhang, F. X.; Tracy, Cameron L.; Lian, Jie; Wang, Z.W.; Weber, William; Severin, D.; Bender, M.; Trautmann, Christina; and Ewing, Rodney C.  Swift heavy ion track formation in Gd2Zr2-xTixO7 pyrochlore: Effect of electronic energy loss  Nuclear Instruments and Methods in Physics Research B, 336, 101-115 (2014).  [DOI: 10.1016/j.nimb.2014.06.019External link] [MSA]
1429.Li, D.; Simotwo, S.; Nyman, May; Liu, Tianbiao; and ,  Evolution of actinyl peroxide clusters U28 in dilute electrolyte solution: Exploring the transition from simple ions to macrionic assemblies  Chemistry - A European Journal, 20, 1683-1690 (2014).  [DOI: 10.1002/chem.201303266External link] [MSA]
1430.Liao, Zuolei; Deb, T.; and Nyman, May  Elucidating self-assembly mechanisms of uranyl peroxide capsules from monomers  Inorganic Chemistry, 53, 10506-10513 (2014).  [DOI: 10.1021/ic501587gExternal link] [MSA]
1431.Lin, Jian ; Diefenbach, K.; Kikugawa, Naoki N.; Baumbach, Ryan E.; and Albrecht-Schmitt, Thomas E.  Dimensional and coordination number reductions in a large family of lathanide tellurite sulfates  Inorganic Chemistry, 53, 8555-8564 (2014).  [DOI: 10.1021/ic501163xExternal link] [MSA]
1432.Lin, Jian ; Chai, Ping; Diefenbach, K.; Shatruk, Michael; and Albrecht-Schmitt, Thomas E.  Challenges in the search for magnetic coupling in 3d-4f materials: Syntheses, structures, and magnetic properties of the lanthanide copper heterobimetallic compounds, RE2Cu(TeO3)2(SO4)2  Chemical Materials, 26, 2187-2194 (2014).  [DOI: 10.1021/cm500252qExternal link] [MSA]
1433.Liu, Bin; Aidhy, Dilpuneet S. ; Zhang, Y.; and Weber, William  Theoretical investigation of thermodynamic stability and mobility of the oxygen vacancy in ThO2-UO2 solid solutions  Phys Chem Chem Phys, 16, 25461-25467 (2014).  [DOI: 10.1039/c4cp03660cExternal link] [MSA]
1434.McGrail, Brendan T.; Sigmon, Ginger E.; Jouffret, L. J.; Andrews, Christopher; and Burns, Peter C  Raman spectroscopic and ESI-MS characterization of uranyl peroxide cage clusters  Inorganic Chemistry, 53, 1562-1569 (2014).  [DOI: 10.1021/ic402570bExternal link] [MSA]
1435.Miro, P.; Vlaisavljevich, Bess; Dzubak, Allison L.; Hu, S.; Burns, Peter C; Cramer, C. J.; Spezia, R.; and Gagliardi, Laura  Uranyl-peroxide nanocapsules in aqueous solution: Force field development and first applications  Journal of Physical Chemistry C, 118, 24730-24740 (2014).  [DOI: 10.1021/jp504147sExternal link] [MSA]
1436.Navrotsky, Alex  Progress and new directions in calorimetry: A 2014 perspective  Journal of the American Ceramic Society, 97, 3349-3359 (2014).  [DOI: 10.1111/jace.13278External link] [MSA]
1437.Navrotsky, Alex  Taking the measure of molten uranium oxide  Science, 346, 916-917 (2014).  [DOI: 10.1126/science.aaa0163External link] [MSA]
1438.Nelson, Anna-Gay D.; Rak, Zsolt; Albrecht-Schmitt, Thomas E.; Becker, U.; and Ewing, Rodney C.  Three new silver uranyl diphosphonates: Structures and properties  Inorganic Chemistry, 53, 2787-2796 (2014).  [DOI: 10.1021/ic401897nExternal link] [MSA]
1439.Oh, George; and Burns, Peter C  Solid-state actinide acid phosphites from phosphorous acid melts  J. Solid State Chemistry, 215, 50-56 (2014).  [DOI: 10.1016/j.jssc.2014.03.029External link] [MSA]
1440.Panasci, A. F.; Harley, S. J.; Zavarin, M.; and Casey, William H.  Kinetic studies of the [NpO2(CO3)3]4- ion at alkaline conditions using 13C NMR  Inorganic Chemistry, 53, 4202-4208 (2014).  [DOI: 10.1021/ic500314vExternal link] [MSA]
1441.Park, S.; Lang, Maik; Tracy, Cameron L.; Zhang, Jiaming; Zhang, Fuxiang; Trautmann, Christina; Kluth, P.; Rodriguez, M. D.; and Ewing, Rodney C.  Swift heavy ion irradiation-induced amorphization of La2Ti2O7  Nuclear Instruments and Methods in Physics Research B, 326, 145-149 (2014).  [DOI: 10.1016/j.nimb.2013.10.088External link] [MSA]
1442.Pike, R.D.; Dziura, T.M.; deButts, J.C.; Murray, C.A.; Kerr, A. T.; and Cahill, Christopher L.  Copper(I) Cyanide Networks with 1-Phenylpiperazine  J. Chemical Crystallography, 44, 42-50 (2014).  [DOI: 10.1007/s10870-013-0482-2External link] [MSA]
1443.Qiu, Jie; Ling, Jie; Sieradzki, Claire; Nguyen, Kevin; Wylie, Ernest Miller; Szymanowski, Jennifer E.S.; and Burns, Peter C  Expanding the crystal chemistry of uranyl peroxides: Four hybrid uranyl-peroxide structures containing EDTA  Inorganic Chemistry, 53, 12084-12091 (2014).  [DOI: 10.1021/ic5018906External link] [MSA]
1444.Qiu, Jie; Ling, Jie; Jouffret, L. J.; Thomas, Rebecca; Szymanowski, Jennifer E.S.; and Burns, Peter C  Water-soluble multi-cage super tetrahedral uranyl peroxide phosphate clusters  Chemical Sciences, 5, 303-310 (2014).  [DOI: 10.1039/C3SC52357HExternal link] [MSA]
1445.Rodriguez, M. D.; Li, W.X.; Trautmann, Christina; Bierschenk, T.; Afra, B.; Schauries, D.; Ewing, Rodney C.; Mudie, S.T.; and Kluth, P.  SAXS and TEM investigation of ion tracks in neodymium-doped yttrium aluminum garnet  Nuclear Instruments and Methods in Physics Research B, 326, 150-153 (2014).  [DOI: 10.1016/j.nimb.2013.10.076External link] [MSA]
1446.Sahu, S.; Unruh, Daniel K.; Forbes, Tori Z.; and Navrotsky, Alex  Energetics of formation and hydration of a porous metal organic nanotube  Chemistry of Materials, 26, 5105-5112 (2014).  [DOI: 10.1021/cm5024053External link] [MSA]
1447.Solomon, Jonathon; Alexandrov, V.; Sadigh, Babak ; Navrotsky, Alex; and Asta, Mark  Computational study of the energetics and defect clustering tendencies for Y and La-doped UO2  Acta Materialia, 78, 282-289 (2014).  [DOI: 10.1016/j.actamat.2014.06.052External link] [MSA]
1448.Spencer, E.C.; Ross, Nancy L.; Surbella, R.G.; and Cahill, Christopher L.  The influence of pressure on the structure of a 2D uranium (VI) carboxyphosphonate compound  Journal of Solid State Chemistry, 218, 1-5 (2014).  [DOI: 10.1016/j.jssc.2014.05.026External link] [MSA]
1449.Tiferet, E.; Gil, A; Bo, C; Shvareva, T. Y.; Nyman, May; and Navrotsky, Alex  The energy landscape of uranyl peroxide species  Chemistry - A European Journal, 20, 3646-3651 (2014).  [DOI: 10.1002/chem.201304076External link] [MSA]
1450.Tiwari, Surya; Rai, Neeraj; and Maginn, Ed J.  Dynamics of actinyl ionic in water: A molecular dynamics simulation study  Physical Chemistry Chemical Physics, 16, 8060-8069 (2014).  [DOI: 10.1039/C3CP54556CExternal link] [MSA]
1451.Tracy, Cameron L.; Pray, J.M.; Lang, Maik; Popovic, Duska; Park, C.; Trautmann, Christina; and Ewing, Rodney C.  Defect accumulation in ThO2 irradiated with swift heavy ions  Nuclear Instruments and Methods in Physics Research B, 326, 169-173 (2014).  [DOI: 10.1016/j.nimb.2013.08.070External link] [MSA]
1452.Wang, J. W.; Ewing, Rodney C.; and Becker, U.  Defect formation energy in pyrochlore: The effect of crystal size  Materials Science Express, 1, 035501 (2014).  [DOI: 10.1088/2053-1591/1/3/035501External link] [MSA]
1453.Wang, J.; Ewing, Rodney C.; and Becker, U.  Average structure and local configuration of excess oxygen in UO2+x  Nature Scientific Reports, 4, 4216 (2014).  [DOI: 10.1038/srep04216External link] [MSA]
1454.Wiss, T.; Hiernaut, J.-P.; Roudil, D.; Colle, J.-Y.; Maugeri, E.; Talip, Z.; Janssen, A.; Rondinella, V.; Konings, R.J.M.; Matzke, H.-J.; and Weber, William  Evolution of spent nuclear fuel in dry storage conditions for millennia and beyond  JOURNAL OF NUCLEAR MATERIALS, 451, 198-206 (2014).  [DOI: 10.1016/j.jnucmat.2014.03.055External link] [MSA]
1455.Wylie, Ernest Miller; Peruski, Kathryn M.; Weidman, J.L.; Phillip, William A.; and Burns, Peter C  Ultrafiltration of uranyl peroxide nanoclusters for the separation of uranium from aqueous solution  ACS Applied Materials and Interfaces, 6, 473-479 (2014).  [DOI: 10.1021/am404520bExternal link] [MSA]
1456.Xin, Guoqing; Sun, H.T.; Fard, F.R.; Koratkar, Nikhil; Borca-Tasciuc, T; and Lian, Jie  Large-area free standing grapheme paper for superior thermal management  Advanced Materials, 26, 4521-4526 (2014).  [DOI: 10.1002/adma.201400951External link] [MSA]
1457.Yu, N.; Klepov, V.V.; Villa, Eric M.; Bosbach, D.; Suleimanov, E.V.; Depmeier, Wulf; Albrecht-Schmitt, Thomas E.; and Alekseev, Evgeny V.  Topologically identical, but geometrically isomeric layers in hydrous -, -Rb[UO2(AsO3OH)(AsO2(OH)2)]•H20 and anhydrous Rb[UO2(AsO3OH)(AsO2(OH)2)]  J. Solid State Chemistry, 215, 152-159 (2014).  [DOI: 10.1016/j.jssc.2014.03.017External link] [MSA]
1458.Zhang, F. X.; Lang, Maik; Tracy, Cameron L.; Ewing, Rodney C.; Gregg, D.J.; and Lumpkin, G.  Incorporation of uranium in pyrochlore oxides and pressure-induced phase transitions  J. Solid State Chemistry, 219, 49-54 (2014).  [DOI: 10.1016/j.jssc.2014.07.011External link] [MSA]
1459.Zhang, F. X.; Lang, Maik; Wang, J.; Li, W.; Sun, K.; Prakapenka, Vitali B. ; Ewing, Rodney C.; and ,  High-pressure U3O8 with the fluorite-type structure  J. Solid State Chemistry, 213, 110-115 (2014).  [DOI:External link] [MSA]
1460.Zhang, Y.; Varga, T.; Ishimaru, M.; Edmondson, P. D.; Xue, H.; Liu, P.; Moll, S.; Namavar, F.; Hardiman, C.; Shannon, S.; and Weber, William  Competing effects of electronic and nuclear energy loss on microstructural evolution in ionic-covalent materials  Nuclear Instrumentation and Methods in Physics Research, B 327, 33-43 (2014).  [DOI: 10.1016/j.nimb.2013.10.095External link] [MSA]
1461.Zhang, Y.; Aidhy, Dilpuneet S. ; Varga, T.; Moll, S.; Edmondson, P. D.; Namavar, F.; Jin, Ke; Ostrouchov, Christopher; and Weber, William  The effect of electronic energy loss on irradiation-induced grain growth in nanocrystalline oxides  Physical Chemistry Chemical Physics, 16, 8051-8059 (2014).  [DOI: 10.1039/c4cp00392fExternal link] [MSA]
1462.Anovitz, L.; Cole, David R.; Swift, Alex; Elston, H.; Welch, Susan A; Chipera, S.J.; Litrell, K. C.; Mildner, David F.R.; and Wasbrough, M.J.  Multiscale (nano to mm) Porosity in the Eagle Ford Shale: Changes as a Function of Maturity  Unconventional Resources Technology Conference (URTeC) Proceedings, , (2014).  [DOI: 10.15530/urtec-2014-1923519External link] [NCGC]
1463.Arthur, Michael A.; and Cole, David R.  Unconventional Hydrocarbon Resources: Prospects and Problems  Elements, 10, 257-264 (2014).  [DOI: 10.2113/gselements.10.4.257External link] [NCGC]
1464.Capobianco, Ryan M; Gruszkiewicz, Mirek; Bodnar, R.J.; and Rimstidt, J. Donald  Conductivity Measurements on H2O-Bearing CO2-Rich Fluids  J Solution Chem, , (2014).  [DOI: 10.1007/s10953-014-0219-7External link] [NCGC]
1465.Chen, Chun-Long; Qi, J.; Tao, J.; Zuckermann, Ronald N.; and DeYoreo, James  Tuning calcite morphology and growth acceleration by a rational design of highly stable protein-mimetics  Nature Scientific Reports, 4, (2014).  [DOI: 10.1038/srep06266External link] [NCGC]
1466.Gazzè, Salvatore A.; Stack, Andrew; Ragnarsdottir, K. Vala; and McMaster, Terence J.  Chlorite topography and dissolution of the interlayer studied with Atomic Force Microscopy  American Mineralogist, 99, 128-138 (2014).  [DOI: 10.2138/am.2014.4478External link] [NCGC]
1467.Hamm, L. M.; Giuffre, Anthony J.; Han, Nizhou; Tao, J.; Wang, Debin; DeYoreo, James; and Dove, P M  Reconciling disparate views of template-directed nucleation through measurement of calcite nucleation kinetics and binding energies  PNAS, 111, 1304-1309 (2014).  [DOI: 10.1073/pnas.1312369111External link] [NCGC]
1468.Li, Q.; Fernandez-Martinez, A.; Lee, Byeongdu; Waychunas, Glenn; and Jun, Young-Shin  Interfacial Energies for Heterogeneous Nucleation of Calcium Carbonate on Mica and Quartz  Environmental Science & Technology, , (2014).  [DOI: 10.1021/es405141jExternal link] [NCGC]
1469.Masson, Yder; and Pride, Steven R.  A Fast Algorithm for Invasion Percolation.  Transport in Porous Media, 102, 301-312 (2014).  [DOI: 10.1007/s11242-014-0277-8External link] [NCGC]
1470.Molins, Sergi; Trebotich, David; Yang, Li; Ajo-Franklin, Jonathan; Ligocki, Terry J.; Shen, Chaopeng; and Steefel, Carl  Pore-Scale Controls on Calcite Dissolution Rates from Flow-through Laboratory and Numerical Experiments  Environmental Science & Technology, 48, 7453-7460 (2014).  [DOI: 10.1021/es5013438External link] [NCGC]
1471.Nielsen, Michael H.; Aloni, Shaul; and DeYoreo, James  In situ TEM imaging of CaCO3 nucleation reveals coexistence of direct and indirect pathways  Science, 345, (2014).  [DOI: 10.1126/science.1254051External link] [NCGC]
1472.Probst, Alex J.; Weinmaier, Thomas; Raymann, Kasie; Perras, Alexandra; Emerson, Joanne B.; Rattei, Thomas; Wanner, Gerhard; Klingl, Andreas; Berg, Ivan A.; Yoshinaga, Marcos; Viehweger, Bernhard; Hinrichs, Kai-Uwe; Thomas, Brian C.; Meck, Sandra; Auerbach, Anna K.; Heise, Matthias; Schintlmeister, Arno; Schmid, Markus; Gribaldo, Simonetta; Banfield, Jillian F. ; Moissl-Eichinger, Christine; and Wagner, Michael  Biology of a widespread uncultivated archaeon that contributes to carbon fixation in the subsurface  Nature Communications, 5, 5947 (2014).  [DOI: 10.1038/ncomms6497.External link] [NCGC]
1473.Radha, A. V.; and Navrotsky, Alex  Manganese carbonate formation from amorphous and nanocrystalline precursors: Thermodynamics and geochemical relevance  American Mineralogist, , (2014).  [DOI: 10.2138/am.2014.4734External link] [NCGC]
1474.Rother, Gernot; Vlcek, Lukas; Gruszkiewicz, Mirek; Chialvo, Ariel A.; Anovitz, L.; Banuelos, J. L.; Wallacher, D.; Grimm, N.; and Cole, David R.  Sorption Phase of Supercritical CO2 in Silica Aerogel: Experiments and Mesoscale Computer Simulations  Journal of Physical Chemistry C, 118, 15525-15533 (2014).  [DOI: 10.1021/jp503739xExternal link] [NCGC]
1475.Stack, Andrew; Fernandez-Martinez, A.; Allard, Lawrence F.; Banuelos, J. L.; Rother, Gernot; Anovitz, L.; Cole, David R.; and Waychunas, Glenn A  Pore-Size-Dependent Calcium Carbonate Precipitation Controlled by Surface Chemistry  Environmental Science & Technology, 48, 6177-6183 (2014).  [DOI: 10.1021/es405574aExternal link] [NCGC]
1476.Stack, Andrew  Next generation models of carbonate mineral growth and dissolution  Greenhouse Gas Sci. Technol., , (2014).  [DOI: 10.1002/ghg.1400External link] [NCGC]
1477.Steefel, Carl; Jennifer, Druhan L.; and Maher, Kate  Modeling Coupled Chemical and Isotopic Equilibration Rates  Procedia Earth and Planetary Science, 10, 208-217 (2014).  [DOI: 10.1016/j.proeps.2014.08.022External link] [NCGC]
1478.Swift, Alex; Sheets, Julia M; Cole, David R.; Anovitz, L.; Welch, Susan A; Gu, X; Mildner, David F.R.; Chipera, S.J.; Buchwalter, Edwin; and Cook, Ann  Nano- to microscale pore characterization of the Utica shale  Unconventional Resources Technology Conference (URTeC) Proceedings, , (2014).  [DOI: 10.15530/urtec-2014-1923522External link] [NCGC]
1479.Swift, Andrew; Anovitz, L.; Sheets, Julia M; Cole, David R.; Welch, Susan A; and Rother, Gernot  Relationship between mineralogy and porosity in seals relevant to geologic CO2 sequestration  Environmental Geosciences, 21, 39-57 (2014).  [DOI: 10.1306/eg.03031413012External link] [NCGC]
1480.Trebotich, David; Adams, M.F.; Molins, Sergi; Steefel, Carl; and Shen, Chaopeng  High resolution simulation of pore scale reactive transport processes associated with carbon sequestration  Computing in Science and Engineering, 16, 22-31 (2014).  [DOI: 10.1109/MCSE.2014.77External link] [NCGC]
1481.Trebotich, David; Adams, M.F.; Molins, Sergi; and Steefel, Carl  High-Resolution Simulation of Pore-Scale Reactive Transport Processes Associated with Carbon Sequestration  Computing in Science and Engineering, 16, 22-31 (2014).  [DOI: 10.1109/MCSE.2014.77External link] [NCGC]
1482.Wan, Jiamin; Kim, Yongman; and Tokunaga, Tetsu K.  Contact angle measurement ambiguity in supercritical CO2–water–mineral systems: Mica as an example  International Journal of Greenhouse Gas Control, 31, 128–137 (2014).  [DOI: 10.1016/j.ijggc.2014.09.029External link] [NCGC]
1483.Watkins, James; Hunt, Jonathan D.; Ryerson, Frederick J.; and DePaolo, Donald J.  The influence of temperature, pH, and growth rate on the δ18O composition of inorganically precipitated calcite  Earth and Planetary Science Letters, 404, 332-343 (2014).  [DOI: 10.1016/j.epsl.2014.07.036External link] [NCGC]
1484.Whitelam, S.; Hedges, Lester; and Schmit, Jeremy D  Self-assembly at a nonequilibrium critical point  Physical Review Letters, 114, (2014).  [DOI: 10.1103/PhysRevLett.112.155504External link] [NCGC]
1485.Wu, Di; Hwang, S. J.; Zones, Stacey I.; and Navrotsky, Alexandra  Guest–host interactions of a rigid organic molecule in porous silica frameworks  Proc Natl Acad Sci U S A., 111, 1720-1725 (2014).  [DOI: 10.1073/pnas.1323989111External link] [NCGC]
1486.Bo, Shou-Hang; Nam, Kyung-Wan; Borkiewicz, Olaf J.; Hu, Yan-Yan; Yang, Xiao-Qing; Chupas, Peter J.; Chapman, Karena W.; Wu, Lijun; Zhang, Lihua; Wang, Feng; Grey, Clare P.; and Khalifah, Peter G.  Structures of Delithiated and Degraded LiFeBO3, and Their Distinct Changes upon Electrochemical Cycling  J. American Chemical Society, 53, 6585-6595 (2014).  [DOI: 10.1021/ic500169gExternal link] [NECCES]
1487.Bo, Shou-Hang; Veith, G. M.; Saccomanno, Michael; Huang, Huafeng; Burmistrova, Polina; Malingowski, Andrew; Sacci, Robert L. ; Kittilstved, Kevin; Grey, Clare P.; and Khalifah, Peter G.  Thin film and bulk investigations of LiCoBO3 as a Li-ion battery cathode  ACS Appl. Mater. Interfaces, , (2014).  [DOI: 10.1021/am500860aExternal link] [NECCES]
1488.Chen, Zehua; Chen, Qiyuan; Wang, Haiyan; Zhang, Ruibo; Zhou, Hui; Chen, Liquan; and Whittingham, M. Stanley  A β-VOPO4/ε-VOPO4 composite Li-ion battery cathode  Electrochemistry Communications, 46, 67-70 (2014).  [DOI: 10.1016/j.elecom.2014.06.009External link] [NECCES]
1489.He, Kai; Zhou, Yongning; Gao, Peng; Wang, Liping; Pereira, Nathalie; Amatucci, Glenn G.; Nam, Kyung-Wan; Yang, Xiao-Qing; Zhu, Yimei; Wang, Feng; and Su, Dong  Sodiation via Heterogeneous Disproportionation in FeF2 Electrodes for Sodium-Ion Batteries  ACS Nano, 8, 7251-7259 (2014).  [DOI: 10.1021/nn502284yExternal link] [NECCES]
1490.Huang, Yiqing; Fang, Jin; Omenya, Frederick O.; O'Shea, Martin; Chernova, Natasha; Zhang, Ruibo; Wang, Qi; Quackenbush, Nicholas F.; Piper, L. F.J.; Scanlon, David O.; and Whittingham, M Stanley  Understanding the stability of MnPO4  J. Mater. Chem. A, , (2014).  [DOI: 10.1039/C4TA00434EExternal link] [NECCES]
1491.Kim, Jae Chul; Li, Xin; Moore, Charles J; Bo, Shou-Hang; Khalifah, Peter G.; Grey, Clare P.; and Ceder, Gerbrand  Analysis of Charged State Stability for Monoclinic of LiMnBO3 Cathode   Chemistry of Materials, 26, 4200-4206 (2014).  [DOI: 10.1021/cm5014174External link] [NECCES]
1492.Ko, Jonathan; Halajko, Anna; Parkinson, Matthew F.; and Amatucci, Glenn G  Electronic Transport in Lithiated Iron and Bismuth Fluoride   Journal of the Electrochemical Society, 162 (1), A149-A154 (2014).  [DOI: 10.1149/2.0621501jesExternal link] [NECCES]
1493.Ko, Jonathan K.; Wiaderek, Kamila M.; Pereira, Nathalie; Kinnibrugh, Tiffany L.; Kim, Joshua R.; Chupas, Peter J.; Chapman, Karena W.; and Amatucci, Glenn G.  Transport, Phase Reactions, and Hysteresis of Iron Fluoride and Oxyfluoride Conversion Electrode Materials for Lithium Batteries  ACS Appl. Mater. Interfaces, , (2014).  [DOI: 10.1021/am500538bExternal link] [NECCES]
1494.Liu, Jue; Chang, Donghee; Whitfield, Pamela; Janssen, Yuri; Yu, Xiqian; Zhou, Yongning; Bai, Jianming; Ko, Jonathan; Nam, Kyung-Wan; Wu, Lijun; Zhu, Yimei; Feygenson, Mikhail; Amatucci, Glenn G; Van der Ven, Anton; Yang, Xiao-Qing; and Khalifah, Peter G.  Ionic conduction in cubic Na3TiP3O9N, a secondary Na-ion battery cathode with extremely low volume change  Chem. Mater., , (2014).  [DOI: 10.1021/cm5011218External link] [NECCES]
1495.Liu, Jue; Yu, Xiqian; Hu, Enyuan; Nam, Kyung-Wan; Yang, Xiao-Qing; and Khalifah, Peter G.  Divalent Iron Nitridophosphates: A New Class of Cathode Materials for Li-Ion Batteries  Chem. Mater., 25, 3929-3931 (2014).  [DOI: 10.1021/cm402567eExternal link] [NECCES]
1496.Omenya, Frederick O.; Wen, Bohua; Fang, Jin; Zhang, Ruibo; Wang, Qi; Chernova, Natasha; Schneider, J; Cosandey, Frederic; and Whittingham, M Stanley  Mg Substitution Clarifies the Reaction Mechanism of Olivine-LiFePO4  Advanced Energy Materials, December 2014, 1401204-1401213 (2014).  [DOI: 10.1002/aenm.201401204External link] [NECCES]
1497.Omenya, Fredrick O.; Miller, Joel K; Fang, Jin; Wen, Bohua; Zhang, Ruibo; Wang, Qi; Chernova, Natasha; and Whittingham, M. Stanley  Single-Phase Lithiation and Delithiation of Simferite Compunds Li(Mg,Mn,Fe)PO4  Chemistry of Materials, 26(21), 6206-6212 (2014).  [DOI: 10.1021/cm502832bExternal link] [NECCES]
1498.Orvananos, Bernardo; Yu, Hui-Chia; Thornton, Katsuyo; Malik, Rahul; Abdellahi, Aziz; Ceder, Gerbrand; and Grey, Clare P.  Architecture Dependence on the Dynamics of Nano-LiFePO4 Electrodes  Electrochimica Acta, , (2014).  [DOI: 10.1016/j.electacta.2014.06.029External link] [NECCES]
1499.Parkinson, Matthew F.; Ko, Jonathan K.; Halajko, Anna; Sanghvi, Sheel; and Amatucci, Glenn G.  Effect of Vertically Structured Porosity on Electrochemical Performance of FeF2 Films for Lithium Batteries  Electrochimica Acta, 125, 71-82 (2014).  [DOI: 10.1016/j.electacta.2014.01.080External link] [NECCES]
1500.Pascal, Tod A.; Boesenberg, Ulrike; Kostecki, Robert; Richardson, Thomas J.; Weng, Tsu-Chen; Sokaris, Dimosthenis; Nordlund, Dennis; McDermott, Eamon; Moewes, Alexander; Cabana, Jordi; and Prendergast, David  Finite temperature effects on the X-ray absorption spectra of lithium compounds: First-principles interpretation of X-ray Raman measurements  J. Chem. Phys., 140, 034107 (2014).  [DOI: 10.1063/1.4856835External link] [NECCES]
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