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Valentino R. Cooper, Ph.D. - Publications

Affiliations: 
2005 University of Pennsylvania, Philadelphia, PA, United States 
Area:
theoretical and computational approaches to study complex systems in materials science, condensed-matter physics, and physical chemistry
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122 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
2024 Yuk SF, Sargin I, Meyer N, Krogel JT, Beckman SP, Cooper VR. Putting error bars on density functional theory. Scientific Reports. 14: 20219. PMID 39215027 DOI: 10.1038/s41598-024-69194-w  0.56
2023 Moseley DH, Juneja R, Daemen LL, Sergueev I, Steinbrügge R, Leupold O, Cheng Y, Cooper VR, Lindsay L, Kidder MK, Manley ME, Hermann RP. Vibrations and Phase Stability in Mixed Valence Antimony Oxide. Inorganic Chemistry. PMID 37747902 DOI: 10.1021/acs.inorgchem.3c02189  0.567
2023 Pu Y, Moseley D, He Z, Pitike KC, Manley ME, Yan J, Cooper VR, Mitchell V, Peterson VK, Johannessen B, Hermann RP, Cao P. (Mg,Mn,Fe,Co,Ni)O: A rocksalt high-entropy oxide containing divalent Mn and Fe. Science Advances. 9: eadi8809. PMID 37729401 DOI: 10.1126/sciadv.adi8809  0.555
2022 Sharma Y, Lee MC, Pitike KC, Mishra KK, Zheng Q, Gao X, Musico BL, Mazza AR, Katiyar RS, Keppens V, Brahlek M, Yarotski DA, Prasankumar RP, Chen A, Cooper VR, et al. High Entropy Oxide Relaxor Ferroelectrics. Acs Applied Materials & Interfaces. PMID 35226475 DOI: 10.1021/acsami.2c00340  0.593
2021 Rahman MA, Bowland C, Ge S, Acharya SR, Kim S, Cooper VR, Chen XC, Irle S, Sokolov AP, Savara A, Saito T. Design of tough adhesive from commodity thermoplastics through dynamic crosslinking. Science Advances. 7: eabk2451. PMID 34652933 DOI: 10.1126/sciadv.abk2451  0.487
2021 Malkowski TF, Sacci RL, McAuliffe RD, Acharya SR, Cooper VR, Dudney NJ, Veith GM. Role of Pairwise Reactions on the Synthesis of LiLaTiO and the Resulting Structure-Property Correlations. Inorganic Chemistry. PMID 34533946 DOI: 10.1021/acs.inorgchem.1c02136  0.585
2021 Cooper VR, Krogel JT, Donald KJ. From Molecules to Solids: A vdW-DF-C09 Case Study of the Mercury Dihalides. The Journal of Physical Chemistry. A. PMID 33724850 DOI: 10.1021/acs.jpca.0c10847  0.581
2020 Jiang B, Bridges CA, Unocic RR, Pitike KC, Cooper VR, Zhang Y, Lin DY, Page K. Probing the Local Site Disorder and Distortion in Pyrochlore High-Entropy Oxides. Journal of the American Chemical Society. PMID 33352040 DOI: 10.1021/jacs.0c10739  0.585
2020 Krogel JT, Yuk SF, Kent PRC, Cooper VR. Perspectives on van der Waals Density Functionals: The Case of TiS. The Journal of Physical Chemistry. A. PMID 33190498 DOI: 10.1021/acs.jpca.0c05973  0.591
2020 May AF, Du M, Cooper VR, McGuire MA. Tuning magnetic order in the van der Waals metal Fe5GeTe2 by cobalt substitution Physical Review Materials. 4. DOI: 10.1103/Physrevmaterials.4.074008  0.614
2020 Brahlek M, Mazza AR, Pitike KC, Skoropata E, Lapano J, Eres G, Cooper VR, Ward TZ. Unexpected crystalline homogeneity from the disordered bond network in La(Cr0.2Mn0.2Fe0.2Co0.2Ni0.2)O3 films Physical Review Materials. 4. DOI: 10.1103/Physrevmaterials.4.054407  0.626
2020 Pitike KC, Marquez-Rossy AE, Flores-Betancourt A, Chen DX, Santosh K, Cooper VR, Lara-Curzio E. On the elastic anisotropy of the entropy-stabilized oxide (Mg, Co, Ni, Cu, Zn)O compound Journal of Applied Physics. 128: 15101. DOI: 10.1063/5.0011352  0.612
2020 Nguyen GD, Pitike KC, Wadley P, Cooper VR, Yoon M, Berlijn T, Li A. Emerging edge states on the surface of the epitaxial semimetal CuMnAs thin film Applied Physics Letters. 116: 061603. DOI: 10.1063/1.5130624  0.629
2020 Pitike KC, Kc S, Eisenbach M, Bridges CA, Cooper VR. Predicting the Phase Stability of Multicomponent High-Entropy Compounds Chemistry of Materials. 32: 7507-7515. DOI: 10.1021/Acs.Chemmater.0C02702  0.568
2019 Ievlev AV, Kc S, Vasudevan RK, Kim Y, Lu X, Alexe M, Cooper VR, Kalinin SV, Ovchinnikova OS. Non-conventional mechanism of ferroelectric fatigue via cation migration. Nature Communications. 10: 3064. PMID 31296880 DOI: 10.1038/S41467-019-11089-W  0.615
2019 Moatti A, Sachan R, Cooper VR, Narayan J. Electrical Transition in Isostructural VO Thin-Film Heterostructures. Scientific Reports. 9: 3009. PMID 30816206 DOI: 10.1038/S41598-019-39529-Z  0.61
2019 Herklotz A, Rus SF, Sohn C, KC S, Cooper VR, Guo E, Ward TZ. Optical response of BiFeO3 films subjected to uniaxial strain Physical Review Materials. 3. DOI: 10.1103/Physrevmaterials.3.094410  0.552
2019 Sims H, Leonard DN, Birenbaum AY, Ge Z, Berlijn T, Li L, Cooper VR, Chisholm MF, Pantelides ST. Intrinsic interfacial van der Waals monolayers and their effect on the high-temperature superconductor FeSe/SrTiO3 Physical Review B. 100. DOI: 10.1103/Physrevb.100.144103  0.635
2019 Liu Y, Cooper VR, Wang B, Xiang H, Li Q, Gao Y, Yang J, Zhou Y, Liu B. Discovery of ABO3 perovskites as thermal barrier coatings through high-throughput first principles calculations Materials Research Letters. 7: 145-151. DOI: 10.1080/21663831.2019.1566183  0.571
2019 Birenbaum AY, Cooper VR, Borisevich A. Tracing Oxygen Transport Pathways with In-Situ STEM and Theory Microscopy and Microanalysis. 25: 1428-1429. DOI: 10.1017/S1431927619007876  0.561
2019 Sharma Y, Agarwal R, Collins L, Zheng Q, Ievlev AV, Hermann RP, Cooper VR, KC S, Ivanov IN, Katiyar RS, Kalinin SV, Lee HN, Hong S, Ward TZ. Self‐Assembled Room Temperature Multiferroic BiFeO 3 ‐LiFe 5 O 8 Nanocomposites Advanced Functional Materials. 30: 1906849. DOI: 10.1002/Adfm.201906849  0.556
2018 Yuk SF, Cooper VR. Tuning oxygen electrocatalysis via strain on LaNiO(001). Physical Chemistry Chemical Physics : Pccp. PMID 30335103 DOI: 10.1039/C8Cp02405G  0.608
2018 Vasudevan RK, Dixit H, Tselev A, Qiao L, Meyer TL, Cooper VR, Baddorf AP, Lee HN, Ganesh P, Kalinin SV. Surface reconstructions and modified surface states in La1−xCaxMnO3 Physical Review Materials. 2. DOI: 10.1103/Physrevmaterials.2.104418  0.549
2018 Zhang L, Bredeson I, Birenbaum AY, Kent PRC, Cooper VR, Ganesh P, Xu H. Oxygen vacancy formation energies in PbTiO3/SrTiO3 superlattice Physical Review Materials. 2. DOI: 10.1103/Physrevmaterials.2.064409  0.621
2018 Bredeson I, Zhang L, Kent PRC, Cooper VR, Xu H. Dimensional control of defect dynamics in perovskite oxide superlattices Physical Review Materials. 2. DOI: 10.1103/Physrevmaterials.2.035401  0.622
2018 Pandey T, Polanco CA, Cooper VR, Parker DS, Lindsay L. Symmetry-driven phonon chirality and transport in one-dimensional and bulk Ba3N -derived materials Physical Review B. 98. DOI: 10.1103/Physrevb.98.241405  0.581
2018 Sheng J, Ye F, Hoffmann C, Cooper VR, Okamoto S, Terzic J, Zheng H, Zhao H, Cao G. Anisotropic antiferromagnetic order in the spin-orbit coupled trigonal-lattice Ca2Sr2IrO6 Physical Review B. 97. DOI: 10.1103/Physrevb.97.235116  0.599
2018 Oxley MP, Birenbaum AY, Pandey T, Cooper VR, Chi M. Accurate Calculation of CBED Patterns for 4D STEM Using Electron Densities Calculated by Density Functional Theory. Microscopy and Microanalysis. 24: 116-117. DOI: 10.1017/S1431927618001071  0.605
2018 Birenbaum AY, Qiao L, Cooper VR, Borisevich A. Towards the Mechanism of Oxygen Vacancy Formation & Ordering via Tracking of Beam-Induced Dynamics and Density Functional Theory Microscopy and Microanalysis. 24: 92-93. DOI: 10.1017/S1431927618000958  0.586
2017 Yuk SF, Pitike KC, Nakhmanson SM, Eisenbach M, Li YW, Cooper VR. Erratum: Towards an accurate description of perovskite ferroelectrics: exchange and correlation effects. Scientific Reports. 7: 46647. PMID 31748550 DOI: 10.1038/srep46647  0.514
2017 Yuk SF, Pitike KC, Nakhmanson SM, Eisenbach M, Li YW, Cooper VR. Erratum: Towards an accurate description of perovskite ferroelectrics: exchange and correlation effects. Scientific Reports. 7: 46647. PMID 28467400 DOI: 10.1038/srep46647  0.535
2017 Yuk SF, Pitike KC, Nakhmanson SM, Eisenbach M, Li YW, Cooper VR. Towards an accurate description of perovskite ferroelectrics: exchange and correlation effects. Scientific Reports. 7: 43482. PMID 28256544 DOI: 10.1038/Srep43482  0.627
2017 McGuire MA, Yan J, Lampen-Kelley P, May AF, Cooper VR, Lindsay L, Puretzky A, Liang L, KC S, Cakmak E, Calder S, Sales BC. High-temperature magnetostructural transition in van der Waals-layered α−MoCl3 Physical Review Materials. 1. DOI: 10.1103/Physrevmaterials.1.064001  0.61
2017 McGuire MA, Clark G, KC S, Chance WM, Jellison GE, Cooper VR, Xu X, Sales BC. Magnetic behavior and spin-lattice coupling in cleavable van der Waals layered CrCl3 crystals Physical Review Materials. 1. DOI: 10.1103/Physrevmaterials.1.014001  0.57
2017 Nichols J, Yuk SF, Sohn C, Jeen H, Freeland JW, Cooper VR, Lee HN. Electronic and magnetic properties of epitaxial SrRhO3 films Physical Review B. 95. DOI: 10.1103/Physrevb.95.245121  0.626
2017 McGuire MA, Garlea VO, KC S, Cooper VR, Yan J, Cao H, Sales BC. Antiferromagnetism in the van der Waals layered spin-lozenge semiconductor CrTe3 Physical Review B. 95. DOI: 10.1103/Physrevb.95.144421  0.618
2017 Herklotz A, Rus SF, KC S, Cooper VR, Huon A, Guo E, Ward TZ. Symmetry driven control of optical properties in WO3 films Apl Materials. 5: 066106. DOI: 10.1063/1.4989395  0.601
2017 Ihm Y, Cooper VR, Vlcek L, Canepa P, Thonhauser T, Shim JH, Morris JR. Continuum Model of Gas Uptake for Inhomogeneous Fluids The Journal of Physical Chemistry C. 121: 17625-17632. DOI: 10.1021/Acs.Jpcc.7B04834  0.603
2017 Sachan R, Cooper VR, Liu B, Aidhy DS, Voas BK, Lang M, Ou X, Trautmann C, Zhang Y, Chisholm MF, Weber WJ. Forging Fast Ion Conducting Nanochannels with Swift Heavy Ions: The Correlated Role of Local Electronic and Atomic Structure The Journal of Physical Chemistry C. 121: 975-981. DOI: 10.1021/Acs.Jpcc.6B12522  0.594
2017 Yaël Birenbaum A, Qiao L, Biegalski MD, Cooper VR, Borisevich AY. Investigating Ionic Transport Anisotropy in Oxygen Deficient Lanthanum Cobaltites via STEM and First Principles Theory Microscopy and Microanalysis. 23: 1410-1411. DOI: 10.1017/S1431927617007711  0.573
2017 Li X, Puretzky AA, Sang X, KC S, Tian M, Ceballos F, Mahjouri-Samani M, Wang K, Unocic RR, Zhao H, Duscher G, Cooper VR, Rouleau CM, Geohegan DB, Xiao K. Transition Metal Dichalcogenides: Suppression of Defects and Deep Levels Using Isoelectronic Tungsten Substitution in Monolayer MoSe2 (Adv. Funct. Mater. 19/2017) Advanced Functional Materials. 27. DOI: 10.1002/Adfm.201770119  0.575
2016 Fan L, Zhuang HL, Zhang K, Cooper VR, Li Q, Lu Y. Chloride-Reinforced Carbon Nanofiber Host as Effective Polysulfide Traps in Lithium-Sulfur Batteries. Advanced Science (Weinheim, Baden-Wurttemberg, Germany). 3: 1600175. PMID 27981007 DOI: 10.1002/Advs.201600175  0.593
2016 Zhuang HL, Zhang L, Xu H, Kent PR, Ganesh P, Cooper VR. Tunable one-dimensional electron gas carrier densities at nanostructured oxide interfaces. Scientific Reports. 6: 25452. PMID 27151049 DOI: 10.1038/Srep25452  0.631
2016 Petrie JR, Cooper VR, Freeland JW, Meyer TL, Zhang Z, Lutterman DA, Lee HN. Enhanced bifunctional oxygen catalysis in strained LaNiO3 perovskites. Journal of the American Chemical Society. PMID 26866808 DOI: 10.1021/Jacs.5B11713  0.6
2016 Cooper VR, Voas BK, Bridges CA, Morris JR, Beckman SP. First principles materials design of novel functional oxides Journal of Advanced Dielectrics. 6. DOI: 10.1142/S2010135X16500119  0.624
2016 Glavic A, Dixit H, Cooper VR, Aczel AA. Constructing a magnetic handle for antiferromagnetic manganites Physical Review B. 93. DOI: 10.1103/Physrevb.93.140413  0.546
2016 Li G, Rangel T, Liu ZF, Cooper VR, Neaton JB. Energy level alignment of self-assembled linear chains of benzenediamine on Au(111) from first principles Physical Review B - Condensed Matter and Materials Physics. 93. DOI: 10.1103/Physrevb.93.125429  0.622
2016 Zhang L, Liu B, Zhuang H, Kent PRC, Cooper VR, Ganesh P, Xu H. Oxygen vacancy diffusion in bulk SrTiO3 from density functional theory calculations Computational Materials Science. 118: 309-315. DOI: 10.1016/J.Commatsci.2016.02.041  0.617
2016 Li X, Puretzky AA, Sang X, KC S, Tian M, Ceballos F, Mahjouri-Samani M, Wang K, Unocic RR, Zhao H, Duscher G, Cooper VR, Rouleau CM, Geohegan DB, Xiao K. Suppression of Defects and Deep Levels Using Isoelectronic Tungsten Substitution in Monolayer MoSe2 Advanced Functional Materials. 27: 1603850. DOI: 10.1002/Adfm.201603850  0.604
2015 Dixit H, Beekman C, Schlepütz CM, Siemons W, Yang Y, Senabulya N, Clarke R, Chi M, Christen HM, Cooper VR. Understanding Strain-Induced Phase Transformations in BiFeO3 Thin Films. Advanced Science (Weinheim, Baden-Wurttemberg, Germany). 2: 1500041. PMID 27980962 DOI: 10.1002/Advs.201500041  0.588
2015 Bhimanapati GR, Lin Z, Meunier V, Jung Y, Cha JJ, Das S, Xiao D, Son Y, Strano MS, Cooper VR, Liang L, Louie SG, Ringe E, Zhou W, Sumpter BG, et al. Recent Advances in Two-Dimensional Materials Beyond Graphene. Acs Nano. PMID 26544756 DOI: 10.1021/Acsnano.5B05556  0.656
2015 Dixit H, Lee JH, Krogel JT, Okamoto S, Cooper VR. Stabilization of weak ferromagnetism by strong magnetic response to epitaxial strain in multiferroic BiFeO3. Scientific Reports. 5: 12969. PMID 26246030 DOI: 10.1038/Srep12969  0.589
2015 Berland K, Cooper VR, Lee K, Schröder E, Thonhauser T, Hyldgaard P, Lundqvist BI. van der Waals forces in density functional theory: a review of the vdW-DF method. Reports On Progress in Physics. Physical Society (Great Britain). 78: 066501. PMID 25978530 DOI: 10.1088/0034-4885/78/6/066501  0.612
2015 Zhuang HL, Cooper VR, Xu H, Ganesh P, Hennig RG, Kent PRC. Rashba effect in single-layer antimony telluroiodide SbTeI Physical Review B - Condensed Matter and Materials Physics. 92. DOI: 10.1103/Physrevb.92.115302  0.592
2015 You JH, Lee JH, Okamoto S, Cooper V, Lee HN. Strain effects on the electronic properties in δ-doped oxide superlattices Journal of Physics D: Applied Physics. 48. DOI: 10.1088/0022-3727/48/8/085303  0.606
2015 You JH, Lee JH, Okamoto S, Cooper V, Lee HN. Erratum: Strain effects on the electronic properties in δ-doped oxide superlattices (2015 J. Phys. D: Appl. Phys. 48 085303) Journal of Physics D: Applied Physics. 48: 139601. DOI: 10.1088/0022-3727/48/13/139601  0.595
2015 McGuire MA, Dixit H, Cooper VR, Sales BC. Coupling of crystal structure and magnetism in the layered, ferromagnetic insulator cri3 Chemistry of Materials. 27: 612-620. DOI: 10.1021/Cm504242T  0.611
2015 Yin X, Cooper VR, Weitering HH, Snijders PC. Surface Chemical Reactivity of Ultrathin Pd(111) Films on Ru(0001): Importance of Orbital Symmetry in the Application of the d-Band Model Journal of Physical Chemistry C. 119: 23495-23502. DOI: 10.1021/Acs.Jpcc.5B06653  0.612
2015 Ruther RE, Dixit H, Pezeshki AM, Sacci RL, Cooper VR, Nanda J, Veith GM. Correlating Local Structure with Electrochemical Activity in Li2MnO3 Journal of Physical Chemistry C. 119: 18022-18029. DOI: 10.1021/Acs.Jpcc.5B03900  0.608
2015 McGuire MA, Dixit H, Cooper VR, Sales BC. Correction to Coupling of Crystal Structure and Magnetism in the Layered, Ferromagnetic Insulator CrI3 Chemistry of Materials. 27: 4165-4165. DOI: 10.1021/Acs.Chemmater.5B01781  0.575
2015 Cooper VR, Donald KJ. First Principles Predictions of Van der Waals Bonded Inorganic Crystal Structures: Test Case, HgCl2 Physics Procedia. 68: 25-31. DOI: 10.1016/J.Phpro.2015.07.104  0.62
2015 Adler J, Adler O, Kreif M, Cohen O, Grosso B, Hashibon A, Cooper VR. Mini-review of Electron Density Visualization Physics Procedia. 68: 2-6. DOI: 10.1016/J.Phpro.2015.07.100  0.567
2015 Grosso B, Cooper VR, Pine P, Hashibon A, Yaish Y, Adler J. Visualization of electronic density Computer Physics Communications. 195: 1-13. DOI: 10.1016/J.Cpc.2015.04.003  0.605
2015 Liu B, Cooper VR, Zhang Y, Weber WJ. Segregation and trapping of oxygen vacancies near the SrTiO3 Σ3 (1 1 2) [ 1 ¯ 1 0 ] tilt grain boundary Acta Materialia. 90: 394-399. DOI: 10.1016/J.Actamat.2015.02.043  0.609
2015 Dixit H, Beekman C, Schlepütz CM, Siemons W, Yang Y, Senabulya N, Clarke R, Chi M, Christen HM, Cooper VR. Thin Films: Understanding Strain-Induced Phase Transformations in BiFeO3 Thin Films (Adv. Sci. 8/2015) Advanced Science. 2. DOI: 10.1002/Advs.201570029  0.567
2014 Ihm Y, Cooper VR, Gallego NC, Contescu CI, Morris JR. Microstructure-Dependent Gas Adsorption: Accurate Predictions of Methane Uptake in Nanoporous Carbons. Journal of Chemical Theory and Computation. 10: 1-4. PMID 26579886 DOI: 10.1021/Ct400875N  0.6
2014 Dixit H, Zhou W, Idrobo JC, Nanda J, Cooper VR. Facet-dependent disorder in pristine high-voltage lithium-manganese-rich cathode material. Acs Nano. 8: 12710-6. PMID 25415876 DOI: 10.1021/Nn505740V  0.618
2014 Cooper VR, Seo SS, Lee S, Kim JS, Choi WS, Okamoto S, Lee HN. Transparent conducting oxides: a δ-doped superlattice approach. Scientific Reports. 4: 6021. PMID 25109668 DOI: 10.1038/Srep06021  0.625
2014 Liu B, Cooper VR, Xu H, Xiao H, Zhang Y, Weber WJ. Composition dependent intrinsic defect structures in SrTiO₃. Physical Chemistry Chemical Physics : Pccp. 16: 15590-6. PMID 24953742 DOI: 10.1039/C4Cp01510J  0.601
2014 Berland K, Arter CA, Cooper VR, Lee K, Lundqvist BI, Schröder E, Thonhauser T, Hyldgaard P. van der Waals density functionals built upon the electron-gas tradition: facing the challenge of competing interactions. The Journal of Chemical Physics. 140: 18A539. PMID 24832347 DOI: 10.1063/1.4871731  0.65
2014 Zhuang HL, Ganesh P, Cooper VR, Xu H, Kent PRC. Understanding the interactions between oxygen vacancies at SrTiO3 (001) surfaces Physical Review B - Condensed Matter and Materials Physics. 90. DOI: 10.1103/Physrevb.90.064106  0.575
2014 Voas BK, Usher TM, Liu X, Li S, Jones JL, Tan X, Cooper VR, Beckman SP. Special quasirandom structures to study the (K0.5Na0.5)Nb O3 random alloy Physical Review B - Condensed Matter and Materials Physics. 90. DOI: 10.1103/Physrevb.90.024105  0.6
2014 Calder S, Cao GX, Okamoto S, Kim JW, Cooper VR, Gai Z, Sales BC, Lumsden MD, Mandrus D, Christianson AD. J eff = 1 2 Mott spin-orbit insulating state close to the cubic limit in Ca 4 IrO 6 Physical Review B - Condensed Matter and Materials Physics. 89. DOI: 10.1103/Physrevb.89.081104  0.587
2014 Sivadas N, Dixit H, Cooper VR, Xiao D. Publisher's Note: Thickness-dependent carrier density at the surface ofSrTiO3(111) slabs [Phys. Rev. B89, 075303 (2014)] Physical Review B. 89. DOI: 10.1103/Physrevb.89.079902  0.58
2014 Sivadas N, Dixit H, Cooper VR, Xiao D. Thickness-dependent carrier density at the surface of SrTiO3 (111) slabs Physical Review B - Condensed Matter and Materials Physics. 89. DOI: 10.1103/Physrevb.89.075303  0.621
2014 Morris JR, Averill FW, Cooper VR. Theoretical studies of Ir5Th and Ir5Ce nanoscale precipitates in Ir Philosophical Magazine. 94: 991-1000. DOI: 10.1080/14786435.2013.875233  0.603
2014 Ihm Y, Cooper VR, Gallego NC, Contescu CI, Morris JR. Microstructure-dependent gas adsorption: Accurate predictions of methane uptake in nanoporous carbons Journal of Chemical Theory and Computation. 10: 1-4. DOI: 10.1021/ct400875n  0.518
2013 Choi WS, Jeen H, Lee JH, Seo SS, Cooper VR, Rabe KM, Lee HN. Reversal of the lattice structure in SrCoO(x) epitaxial thin films studied by real-time optical spectroscopy and first-principles calculations. Physical Review Letters. 111: 097401. PMID 24033069 DOI: 10.1103/Physrevlett.111.097401  0.627
2013 Choi WS, Jeen H, Lee JH, Seo SSA, Cooper VR, Rabe KM, Lee HN. Reversal of the lattice structure in SrCoOx epitaxial thin films studied by real-time optical spectroscopy and first-principles calculations Physical Review Letters. 111. DOI: 10.1103/PhysRevLett.111.097401  0.55
2013 Morris JR, Contescu CI, Chisholm MF, Cooper VR, Guo J, He L, Ihm Y, Mamontov E, Melnichenko YB, Olsen RJ, Pennycook SJ, Stone MB, Zhang H, Gallego NC. Modern approaches to studying gas adsorption in nanoporous carbons Journal of Materials Chemistry A. 1: 9341-9350. DOI: 10.1039/C3Ta10701A  0.578
2013 Cooper VR, Morris JR, Takagi S, Singh DJ. Correction to La-Driven Morphotropic Phase Boundary in the Bi(Zn1/2Ti1/2)O3–La(Zn1/2Ti1/2)O3–PbTiO3 Solid Solution Chemistry of Materials. 25: 3777-3777. DOI: 10.1021/Cm402811Y  0.564
2012 Ihm Y, Cooper VR, Peng L, Morris JR. The influence of dispersion interactions on the hydrogen adsorption properties of expanded graphite. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 24: 424205. PMID 23032350 DOI: 10.1088/0953-8984/24/42/424205  0.624
2012 Choi WS, Lee S, Cooper VR, Lee HN. Fractionally δ-doped oxide superlattices for higher carrier mobilities. Nano Letters. 12: 4590-4. PMID 22928746 DOI: 10.1021/Nl301844Z  0.608
2012 Siemons W, McGuire MA, Cooper VR, Biegalski MD, Ivanov IN, Jellison GE, Boatner LA, Sales BC, Christen HM. Dielectric-constant-enhanced hall mobility in complex oxides. Advanced Materials (Deerfield Beach, Fla.). 24: 3965-9. PMID 22718520 DOI: 10.1002/Adma.201104665  0.605
2012 Cooper VR. Enhanced carrier mobilities in two-dimensional electron gases at III-III/I-V oxide heterostructure interfaces Physical Review B - Condensed Matter and Materials Physics. 85. DOI: 10.1103/Physrevb.85.235109  0.608
2012 Li G, Tamblyn I, Cooper VR, Gao HJ, Neaton JB. Molecular adsorption on metal surfaces with van der Waals density functionals Physical Review B - Condensed Matter and Materials Physics. 85. DOI: 10.1103/Physrevb.85.121409  0.619
2012 Liu H, Cooper VR, Dai S, Jiang DE. Windowed carbon nanotubes for efficient CO2 removal from natural gas Journal of Physical Chemistry Letters. 3: 3343-3347. DOI: 10.1021/Jz301576S  0.552
2012 Cooper VR, Morris JR, Takagi S, Singh DJ. La-driven morphotrophic phase boundary in the Bi(Zn1/2Ti 1/2)O3-La(Zn1/2Ti1/2)O 3-PbTiO3 solid solution Chemistry of Materials. 24: 4477-4482. DOI: 10.1021/Cm303059H  0.596
2012 Cooper VR, Ihm Y, Morris JR. Hydrogen Adsorption at the Graphene Surface: A vdW-DF Perspective Physics Procedia. 34: 34-38. DOI: 10.1016/J.Phpro.2012.05.005  0.612
2011 Berland K, Chakarova-Käck SD, Cooper VR, Langreth DC, Schröder E. A van der Waals density functional study of adenine on graphene: single-molecular adsorption and overlayer binding. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 23: 135001. PMID 21403239 DOI: 10.1088/0953-8984/23/13/135001  0.585
2011 Xu B, Singh DJ, Cooper VR, Feng YP. Design of a low band gap oxide ferroelectric: Bi6Ti 4O17 Epl. 94. DOI: 10.1209/0295-5075/94/37006  0.605
2011 Li G, Cooper VR, Cho JH, Du S, Gao HJ, Zhang Z. Self-assembly of molecular wires on H-terminated Si(100) surfaces driven by London dispersion forces Physical Review B - Condensed Matter and Materials Physics. 84. DOI: 10.1103/Physrevb.84.241406  0.582
2011 Takagi S, Cooper VR, Singh DJ. Cooperative behavior of Zn cations in Bi-based perovskites: A comparison of (Bi,Sr)2ZnNbO6 and (Bi,Sr)2MgNbO6 Physical Review B - Condensed Matter and Materials Physics. 83. DOI: 10.1103/Physrevb.83.115130  0.609
2011 Xu B, Cooper VR, Singh DJ, Feng YP. Relationship between bond stiffness and electrical energy storage capacity in oxides: Density functional calculations for h-La2O3, MgO, and BeO Physical Review B - Condensed Matter and Materials Physics. 83. DOI: 10.1103/Physrevb.83.064115  0.619
2011 Cooper VR, Henry AS, Takagi S, Singh DJ. First principles prediction of a morphotropic phase boundary in the Bi (Zn1/2 Ti1/2) O3 - (Bi1/2 Sr1/2) (Zn1/2 Nb1/2) O3 alloy Applied Physics Letters. 98. DOI: 10.1063/1.3570626  0.598
2010 Morris JR, Averill FW, He H, Pan B, Cooper VR, Peng L. Lattice strain effects in graphane and partially-hydrogenated graphene sheets Materials Research Society Symposium Proceedings. 1216: 76-81. DOI: 10.1557/Proc-1216-W03-10  0.601
2010 Takagi S, Subedi A, Cooper VR, Singh DJ. Effect of A -site size difference on polar behavior in M BiScNbO 6 (M=Na, K, and Rb): Density functional calculations Physical Review B - Condensed Matter and Materials Physics. 82. DOI: 10.1103/Physrevb.82.134108  0.574
2010 Cooper VR. Van der Waals density functional: An appropriate exchange functional Physical Review B - Condensed Matter and Materials Physics. 81. DOI: 10.1103/Physrevb.81.161104  0.626
2010 Takagi S, Subedi A, Singh DJ, Cooper VR. Polar behavior of the double perovskites BiM ZnNbO6 ( M=Pb and Sr) from density-functional calculations Physical Review B - Condensed Matter and Materials Physics. 81. DOI: 10.1103/Physrevb.81.134106  0.615
2010 Cooper VR, Kong L, Langreth DC. Computing dispersion interactions in density functional theory Physics Procedia. 3: 1417-1430. DOI: 10.1016/J.Phpro.2010.01.201  0.633
2009 Langreth DC, Lundqvist BI, Chakarova-Käck SD, Cooper VR, Dion M, Hyldgaard P, Kelkkanen A, Kleis J, Kong L, Li S, Moses PG, Murray E, Puzder A, Rydberg H, Schröder E, et al. A density functional for sparse matter. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 21: 084203. PMID 21817355 DOI: 10.1088/0953-8984/21/8/084203  0.622
2009 Jiang DE, Cooper VR, Dai S. Porous graphene as the ultimate membrane for gas separation. Nano Letters. 9: 4019-24. PMID 19995080 DOI: 10.1021/Nl9021946  0.593
2009 Li S, Cooper VR, Thonhauser T, Lundqvist BI, Langreth DC. Stacking interactions and DNA intercalation. The Journal of Physical Chemistry. B. 113: 11166-72. PMID 19719266 DOI: 10.1021/Jp905765C  0.583
2009 Mason SE, Sokol EA, Cooper VR, Rappe AM. Spontaneous formation of dipolar metal nanoclusters. The Journal of Physical Chemistry. A. 113: 4134-7. PMID 19290645 DOI: 10.1021/Jp8105088  0.741
2009 Averill FW, Morris JR, Cooper VR. Calculated properties of fully hydrogenated single layers of BN, BC2 N, and graphene: Graphane and its BN-containing analogues Physical Review B - Condensed Matter and Materials Physics. 80. DOI: 10.1103/Physrevb.80.195411  0.603
2009 Cooper VR, Rabe KM. Enhancing piezoelectricity through polarization-strain coupling in ferroelectric superlattices Physical Review B - Condensed Matter and Materials Physics. 79. DOI: 10.1103/Physrevb.79.180101  0.597
2009 Kong L, Cooper VR, Nijem N, Li K, Li J, Chabal YJ, Langreth DC. Theoretical and experimental analysis of H2 binding in a prototypical metal-organic framework material Physical Review B - Condensed Matter and Materials Physics. 79. DOI: 10.1103/Physrevb.79.081407  0.601
2008 Li S, Cooper VR, Thonhauser T, Puzder A, Langreth DC. A density functional theory study of the benzene-water complex. The Journal of Physical Chemistry. A. 112: 9031-6. PMID 18729422 DOI: 10.1021/Jp801693P  0.602
2008 Cooper VR, Thonhauser T, Langreth DC. An application of the van der Waals density functional: Hydrogen bonding and stacking interactions between nucleobases. The Journal of Chemical Physics. 128: 204102. PMID 18513005 DOI: 10.1063/1.2924133  0.611
2008 Hooper J, Cooper VR, Thonhauser T, Romero NA, Zerilli F, Langreth DC. Predicting C-H/pi interactions with nonlocal density functional theory. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. 9: 891-5. PMID 18383059 DOI: 10.1002/Cphc.200700715  0.613
2008 Cooper VR, Thonhauser T, Puzder A, Schröder E, Lundqvist BI, Langreth DC. Stacking interactions and the twist of DNA. Journal of the American Chemical Society. 130: 1304-8. PMID 18163624 DOI: 10.1021/Ja0761941  0.576
2007 Thonhauser T, Cooper VR, Li S, Puzder A, Hyldgaard P, Langreth DC. Van der Waals density functional: Self-consistent potential and the nature of the van der Waals bond Physical Review B - Condensed Matter and Materials Physics. 76. DOI: 10.1103/Physrevb.76.125112  0.619
2007 Cooper VR, Johnston K, Rabe KM. Polarization enhancement in short period superlattices via interfacial intermixing Physical Review B - Condensed Matter and Materials Physics. 76. DOI: 10.1103/Physrevb.76.020103  0.612
2005 Gomez MA, Griffin MA, Jindal S, Rule KD, Cooper VR. The effect of octahedral tilting on proton binding sites and transition states in pseudo-cubic perovskite oxides. The Journal of Chemical Physics. 123: 94703. PMID 16164358 DOI: 10.1063/1.2035099  0.581
2005 Cooper VR, Kolpak AM, Yourdshahyan Y, Rappe AM. Supported metal electronic structure: Implications for molecular adsorption Physical Review B - Condensed Matter and Materials Physics. 72. DOI: 10.1103/Physrevb.72.081409  0.774
2005 Shin YH, Cooper VR, Grinberg I, Rappe AM. Development of a bond-valence molecular-dynamics model for complex oxides Physical Review B - Condensed Matter and Materials Physics. 71. DOI: 10.1103/Physrevb.71.054104  0.747
2004 Grinberg I, Cooper VR, Rappe AM. Oxide chemistry and local structure of PbZrxTi 1-xO3 studied by density-functional theory supercell calculations Physical Review B - Condensed Matter and Materials Physics. 69: 144118-1-144118-17. DOI: 10.1103/Physrevb.69.144118  0.763
2004 Grinberg I, Cooper VR, Shin YH, Rappe AM, Baring TJ, Cable SB. Accelerated modeling and new ferroelectric materials for Naval SONAR Proceedings - Department of Defense High Performance Computing Modernization Program Users Group Conference, Ugc 2004. 27-33.  0.583
2004 Cooper VR, Kolpak AM, Rappe AM. Oxide-supported metal thin film catalysts: The how and why? Acs National Meeting Book of Abstracts. 228: CATL-25.  0.734
2003 Yourdshahyan Y, Grinberg I, Sai N, Cooper VR, Mason SE, Rappe AM, Kauffman RP. Relating fundamental chemistry and smart materials with DFT calculations Proceedings - 2003 User Group Conference. 20-35. DOI: 10.1109/DODUGC.2003.1253370  0.766
2003 Yourdshahyan Y, Cooper VR, Kolpak AM, Rappe AM. Catalytic behavior at the nanoscale: CO adsorption on Al2O 3-supported Pt clusters Proceedings of Spie - the International Society For Optical Engineering. 5223: 223-231.  0.727
2002 Grinberg I, Cooper VR, Rappe AM. Relationship between local structure and phase transitions of a disordered solid solution. Nature. 419: 909-11. PMID 12410319 DOI: 10.1038/Nature01115  0.757
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