Result Number | Material Type | Add to My Shelf Action | Record Details and Options |
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1 |
Material Type: Artigo
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Sampling Polymorphs of Ionic Solids using Random SuperlatticesStevanovic, VladanPhysical review letters, 2016-02, Vol.116 (7), p.075503-075503, Article 075503 [Periódico revisado por pares]United States: American Physical SocietyTexto completo disponível |
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2 |
Material Type: Artigo
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Correcting density functional theory for accurate predictions of compound enthalpies of formation: Fitted elemental-phase reference energiesStevanović, Vladan ; Lany, Stephan ; Zhang, Xiuwen ; Zunger, AlexPhysical Review. B, Condensed Matter and Materials Physics, 2012-03, Vol.85 (11), Article 115104 [Periódico revisado por pares]United StatesTexto completo disponível |
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3 |
Material Type: Artigo
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Computationally guided discovery of thermoelectric materialsGorai, Prashun ; Stevanović, Vladan ; Toberer, Eric S.Nature reviews. Materials, 2017-08, Vol.2 (9), p.17053, Article 17053 [Periódico revisado por pares]London: Nature Publishing GroupSem texto completo |
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4 |
Material Type: Artigo
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A computational framework for automation of point defect calculationsGoyal, Anuj ; Gorai, Prashun ; Peng, Haowei ; Lany, Stephan ; Stevanović, VladanComputational materials science, 2017-04, Vol.130, p.1-9 [Periódico revisado por pares]United States: Elsevier B.VTexto completo disponível |
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5 |
Material Type: Artigo
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Searching for “Defect-Tolerant” Photovoltaic Materials: Combined Theoretical and Experimental ScreeningBrandt, Riley E ; Poindexter, Jeremy R ; Gorai, Prashun ; Kurchin, Rachel C ; Hoye, Robert L. Z ; Nienhaus, Lea ; Wilson, Mark W. B ; Polizzotti, J. Alexander ; Sereika, Raimundas ; Žaltauskas, Raimundas ; Lee, Lana C ; MacManus-Driscoll, Judith L ; Bawendi, Moungi ; Stevanović, Vladan ; Buonassisi, TonioChemistry of materials, 2017-06, Vol.29 (11), p.4667-4674 [Periódico revisado por pares]United States: American Chemical SocietyTexto completo disponível |
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6 |
Material Type: Artigo
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Assessing capability of semiconductors to split water using ionization potentials and electron affinities onlyStevanović, Vladan ; Lany, Stephan ; Ginley, David S ; Tumas, Willam ; Zunger, AlexPhysical Chemistry Chemical Physics, 2014-02, Vol.16 (8), p.3706-3714 [Periódico revisado por pares]EnglandTexto completo disponível |
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7 |
Material Type: Artigo
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Investigation of n-type doping strategies for Mg3Sb2Gorai, Prashun ; Ortiz, Brenden R ; Toberer, Eric S ; Stevanović, VladanJournal of materials chemistry. A, Materials for energy and sustainability, 2018, Vol.6 (28), p.13806-13815 [Periódico revisado por pares]Cambridge: Royal Society of ChemistryTexto completo disponível |
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8 |
Material Type: Artigo
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Matching crystal structures atom-to-atomTherrien, Félix ; Graf, Peter ; Stevanović, VladanThe Journal of chemical physics, 2020-02, Vol.152 (7), p.074106-074106 [Periódico revisado por pares]United States: American Institute of PhysicsTexto completo disponível |
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9 |
Material Type: Artigo
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Physical descriptor for the Gibbs energy of inorganic crystalline solids and temperature-dependent materials chemistryBartel, Christopher J ; Millican, Samantha L ; Deml, Ann M ; Rumptz, John R ; Tumas, William ; Weimer, Alan W ; Lany, Stephan ; Stevanović, Vladan ; Musgrave, Charles B ; Holder, Aaron MNature communications, 2018-10, Vol.9 (1), p.4168-10, Article 4168 [Periódico revisado por pares]England: Nature Publishing GroupTexto completo disponível |
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10 |
Material Type: Artigo
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Identifying defect-tolerant semiconductors with high minority-carrier lifetimes: beyond hybrid lead halide perovskitesBrandt, Riley E. ; Stevanović, Vladan ; Ginley, David S. ; Buonassisi, TonioMRS Commun, 2015-06, Vol.5 (2), p.265-275 [Periódico revisado por pares]New York, USA: Cambridge University PressTexto completo disponível |