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BaCu2Sn(S,Se)4: Earth-Abundant Chalcogenides for Thin-Film Photovoltaics
Shin, Donghyeop, Saparov, Bayrammurad, Zhu, Tong, Huhn, William P, Blum, Volker, Mitzi, David B
Published in Chemistry of materials (12.07.2016)
Published in Chemistry of materials (12.07.2016)
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I2–II–IV–VI4 (I = Cu, Ag; II = Sr, Ba; IV = Ge, Sn; VI = S, Se): Chalcogenides for Thin-Film Photovoltaics
Zhu, Tong, Huhn, William P, Wessler, Garrett C, Shin, Donghyeop, Saparov, Bayrammurad, Mitzi, David B, Blum, Volker
Published in Chemistry of materials (26.09.2017)
Published in Chemistry of materials (26.09.2017)
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Tunable Semiconductors: Control over Carrier States and Excitations in Layered Hybrid Organic-Inorganic Perovskites
Liu, Chi, Huhn, William, Du, Ke-Zhao, Vazquez-Mayagoitia, Alvaro, Dirkes, David, You, Wei, Kanai, Yosuke, Mitzi, David B, Blum, Volker
Published in Physical review letters (04.10.2018)
Published in Physical review letters (04.10.2018)
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The Elephant in the Room of Density Functional Theory Calculations
Jensen, Stig Rune, Saha, Santanu, Flores-Livas, José A, Huhn, William, Blum, Volker, Goedecker, Stefan, Frediani, Luca
Published in The journal of physical chemistry letters (06.04.2017)
Published in The journal of physical chemistry letters (06.04.2017)
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Molecular NMR shieldings, J-couplings, and magnetizabilities from numeric atom-centered orbital based density-functional calculations
Laasner, Raul, Mandzhieva, Iuliia, Huhn, William P, Colell, Johannes, Yu, Victor Wen-zhe, Warren, Warren S, Theis, Thomas, Blum, Volker
Published in Electronic structure (01.06.2024)
Published in Electronic structure (01.06.2024)
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ELSI: A unified software interface for Kohn–Sham electronic structure solvers
Yu, Victor Wen-zhe, Corsetti, Fabiano, García, Alberto, Huhn, William P., Jacquelin, Mathias, Jia, Weile, Lange, Björn, Lin, Lin, Lu, Jianfeng, Mi, Wenhui, Seifitokaldani, Ali, Vázquez-Mayagoitia, Álvaro, Yang, Chao, Yang, Haizhao, Blum, Volker
Published in Computer physics communications (01.01.2018)
Published in Computer physics communications (01.01.2018)
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Thermodynamic Equilibria in Carbon Nitride Photocatalyst Materials and Conditions for the Existence of Graphitic Carbon Nitride g‑C3N4
Botari, Tiago, Huhn, William Paul, Lau, Vincent Wing-hei, Lotsch, Bettina V., Blum, Volker
Published in Chemistry of materials (23.05.2017)
Published in Chemistry of materials (23.05.2017)
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ELSI — An open infrastructure for electronic structure solvers
Yu, Victor Wen-zhe, Campos, Carmen, Dawson, William, García, Alberto, Havu, Ville, Hourahine, Ben, Huhn, William P., Jacquelin, Mathias, Jia, Weile, Keçeli, Murat, Laasner, Raul, Li, Yingzhou, Lin, Lin, Lu, Jianfeng, Moussa, Jonathan, Roman, Jose E., Vázquez-Mayagoitia, Álvaro, Yang, Chao, Blum, Volker
Published in Computer physics communications (01.11.2020)
Published in Computer physics communications (01.11.2020)
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Direct and cost-efficient hyperpolarization of long-lived nuclear spin states on universal 15N2-diazirine molecular tags
Theis, Thomas, Ortiz, Gerardo X., Logan, Angus W. J., Claytor, Kevin E., Feng, Yesu, Huhn, William P., Blum, Volker, Malcolmson, Steven J., Chekmenev, Eduard Y., Wang, Qiu, Warren, Warren S.
Published in Science advances (01.03.2016)
Published in Science advances (01.03.2016)
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The CECAM electronic structure library and the modular software development paradigm
Oliveira, Micael J. T., Papior, Nick, Pouillon, Yann, Blum, Volker, Artacho, Emilio, Caliste, Damien, Corsetti, Fabiano, de Gironcoli, Stefano, Elena, Alin M., García, Alberto, García-Suárez, Víctor M., Genovese, Luigi, Huhn, William P., Huhs, Georg, Kokott, Sebastian, Küçükbenli, Emine, Larsen, Ask H., Lazzaro, Alfio, Lebedeva, Irina V., Li, Yingzhou, López-Durán, David, López-Tarifa, Pablo, Lüders, Martin, Marques, Miguel A. L., Minar, Jan, Mohr, Stephan, Mostofi, Arash A., O’Cais, Alan, Payne, Mike C., Ruh, Thomas, Smith, Daniel G. A., Soler, José M., Strubbe, David A., Tancogne-Dejean, Nicolas, Tildesley, Dominic, Torrent, Marc, Yu, Victor Wen-zhe
Published in The Journal of chemical physics (14.07.2020)
Published in The Journal of chemical physics (14.07.2020)
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Band Gap Tailoring and Structure-Composition Relationship within the Alloyed Semiconductor Cu 2 BaGe 1– x Sn x Se 4
Wessler, Garrett C., Zhu, Tong, Sun, Jon-Paul, Harrell, Alexis, Huhn, William P., Blum, Volker, Mitzi, David B.
Published in Chemistry of materials (25.09.2018)
Published in Chemistry of materials (25.09.2018)
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ChemInform Abstract: BaCu2Sn(S,Se)4: Earth‐Abundant Chalcogenides for Thin‐Film Photovoltaics
Shin, Donghyeop, Saparov, Bayrammurad, Zhu, Tong, Huhn, William P., Blum, Volker, Mitzi, David B.
Published in ChemInform (01.09.2016)
Published in ChemInform (01.09.2016)
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Thermodynamic Equilibria in Carbon Nitride Photocatalyst Materials and Conditions for the Existence of Graphitic Carbon Nitride g-C 3 N 4
Botari, Tiago, Huhn, William Paul, Lau, Vincent Wing-hei, Lotsch, Bettina V., Blum, Volker
Published in Chemistry of materials (23.05.2017)
Published in Chemistry of materials (23.05.2017)
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I 2 –II–IV–VI 4 (I = Cu, Ag; II = Sr, Ba; IV = Ge, Sn; VI = S, Se): Chalcogenides for Thin-Film Photovoltaics
Zhu, Tong, Huhn, William P., Wessler, Garrett C., Shin, Donghyeop, Saparov, Bayrammurad, Mitzi, David B., Blum, Volker
Published in Chemistry of materials (26.09.2017)
Published in Chemistry of materials (26.09.2017)
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BaCu 2 Sn(S,Se) 4 : Earth-Abundant Chalcogenides for Thin-Film Photovoltaics
Shin, Donghyeop, Saparov, Bayrammurad, Zhu, Tong, Huhn, William P., Blum, Volker, Mitzi, David B.
Published in Chemistry of materials (12.07.2016)
Published in Chemistry of materials (12.07.2016)
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ELSI — An open infrastructure for electronic structure solvers
Yu, Victor Wen-zhe, Campos, Carmen, Dawson, William, García, Alberto, Havu, Ville, Hourahine, Ben, Huhn, William P., Jacquelin, Mathias, Jia, Weile, Keçeli, Murat, Laasner, Raul, Li, Yingzhou, Lin, Lin, Lu, Jianfeng, Moussa, Jonathan, Roman, Jose E., Vázquez-Mayagoitia, Álvaro, Yang, Chao, Blum, Volker
Published in Computer physics communications (24.06.2020)
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Published in Computer physics communications (24.06.2020)
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ELSI — An open infrastructure for electronic structure solvers
Yu, Victor Wen-zhe, Campos, Carmen, Dawson, William, García, Alberto, Havu, Ville, Hourahine, Ben, Huhn, William P., Jacquelin, Mathias, Jia, Weile, Keçeli, Murat, Laasner, Raul, Li, Yingzhou, Lin, Lin, Lu, Jianfeng, Moussa, Jonathan, Roman, Jose E., Vázquez-Mayagoitia, Álvaro, Yang, Chao, Blum, Volker
Published in Computer physics communications (24.06.2020)
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Published in Computer physics communications (24.06.2020)
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Candidate photoferroic absorber materials for thin-film solar cells from naturally occurring minerals: enargite, stephanite, and bournonite
Wallace, Suzanne K., Svane, Katrine L., Huhn, William P., Zhu, Tong, Mitzi, David B., Blum, Volker, Walsh, Aron
Published in Sustainable energy & fuels (01.08.2017)
Published in Sustainable energy & fuels (01.08.2017)
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