AFLOW: An automatic framework for high-throughput materials discovery von Curtarolo, Stefano, Setyawan, Wahyu, Hart, Gus L.W., Jahnatek, Michal, Chepulskii, Roman V., Taylor, Richard H., Wang, Shidong, Xue, Junkai, Yang, Kesong, Levy, Ohad, Mehl, Michael J., Stokes, Harold T., Demchenko, Denis O., Morgan, Dane

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Ab Initio Insights on the Shapes of Platinum Nanocatalysts von Chepulskii, Roman V, Curtarolo, Stefano

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First-principles study of the Fe | MgO(0 0 1) interface: magnetic anisotropy von Bose, Thomas, Cuadrado, Ramon, Evans, Richard F L, Chepulskii, Roman V, Apalkov, Dmytro, Chantrell, Roy W

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Ordered Structures in Rhenium Binary Alloys from First-Principles Calculations von Levy, Ohad, Jahnátek, Michal, Chepulskii, Roman V, Hart, Gus L. W, Curtarolo, Stefano

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The New Face of Rhodium Alloys: Revealing Ordered Structures from First Principles von Levy, Ohad, Chepulskii, Roman V, Hart, Gus L. W, Curtarolo, Stefano

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Calculation of solubility in titanium alloys from first principles von Chepulskii, Roman V., Curtarolo, Stefano

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Accelerating disorder–order transitions of FePt by preforming a metastable AgPt phase von Wen, Wei-Chih, Chepulskii, Roman V., Wang, Liang-Wei, Curtarolo, Stefano, Lai, Chih-Huang

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Revealing low-temperature atomic ordering in bulk Co-Pt with the high-throughput ab-initio method von Chepulskii, Roman V., Curtarolo, Stefano

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First principles study of Ag, Au, and Cu surface segregation in FePt-L1 von Chepulskii, Roman V., Curtarolo, Stefano

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Ab initio magnetocrystalline anisotropy at nanoscale: The case of FePt von Chepulskii, Roman V., Butler, W. H.

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Surface segregation in nanoparticles from first principles: The case of FePt von Chepulskii, Roman V., Butler, W.H., van de Walle, A., Curtarolo, Stefano

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First principles study of Ag, Au, and Cu surface segregation in FePt-L 1 0 von Chepulskii, Roman V., Curtarolo, Stefano

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Site-Resolved Contributions to the Magnetic-Anisotropy Energy and Complex Spin Structure of Fe/MgO Sandwiches von Cuadrado, Ramón, Oroszlány, László, Deák, András, Ostler, Thomas A, Meo, Andrea, Chepulskii, Roman V, Apalkov, Dmytro, Evans, Richard F.L, Szunyogh, László, Chantrell, Roy W

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Site-Resolved Contributions to the Magnetic-Anisotropy Energy and Complex Spin Structure of Fe/MgO Sandwiches von Cuadrado, Ramón, Oroszlány, László, Deák, András, Ostler, Thomas A, Meo, Andrea, Chepulskii, Roman V, Apalkov, Dmytro, Evans, Richard F.L, Szunyogh, László, Chantrell, Roy W

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First-principles study of the Fe von Bose, Thomas, Cuadrado, Ramon, Evans, Richard F L, Chepulskii, Roman V, Apalkov, Dmytro, Chantrell, Roy W

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Site-Resolved Contributions to the Magnetic-Anisotropy Energy and Complex Spin Structure of Fe/MgO Sandwiches von Cuadrado, Ramón, Oroszlány, László, Deák, András, Ostler, Thomas A, Meo, Andrea, Chepulskii, Roman V, Apalkov, Dmytro, Evans, Richard F. L, Szunyogh, László, Chantrell, Roy W

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Site-Resolved Contributions to the Magnetic-Anisotropy Energy and Complex Spin Structure of Fe/MgO Sandwiches von Cuadrado, Ramón, Oroszlány, László, Deák, András, Ostler, Thomas A, Meo, Andrea, Chepulskii, Roman V, Apalkov, Dmytro, Evans, Richard F. L, Szunyogh, László, Chantrell, Roy W

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Calculation of solubility in titanium alloys from first-principles von Chepulskii, Roman V, Curtarolo, Stefano

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The AFLOW Fleet for Materials Discovery von Toher, Cormac, Oses, Corey, Hicks, David, Gossett, Eric, Rose, Frisco, Nath, Pinku, Usanmaz, Demet, Ford, Denise C, Perim, Eric, Calderon, Camilo E, Plata, Jose J, Lederer, Yoav, Jahnátek, Michal, Setyawan, Wahyu, Wang, Shidong, Xue, Junkai, Rasch, Kevin, Chepulskii, Roman V, Taylor, Richard H, Gomez, Geena, Shi, Harvey, Supka, Andrew R, Orabi, Rabih Al Rahal Al, Gopal, Priya, Cerasoli, Frank T, Liyanage, Laalitha, Wang, Haihang, Siloi, Ilaria, Agapito, Luis A, Nyshadham, Chandramouli, Hart, Gus L. W, Carrete, Jesús, Legrain, Fleur, Mingo, Natalio, Zurek, Eva, Isayev, Olexandr, Tropsha, Alexander, Sanvito, Stefano, Hanson, Robert M, Takeuchi, Ichiro, Mehl, Michael J, Kolmogorov, Aleksey N, Yang, Kesong, D'Amico, Pino, Calzolari, Arrigo, Costa, Marcio, De Gennaro, Riccardo, Nardelli, Marco Buongiorno, Fornari, Marco, Levy, Ohad, Curtarolo, Stefano

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ChemInform Abstract: The New Face of Rhodium Alloys: Revealing Ordered Structures from First Principles von Levy, Ohad, Chepulskii, Roman V., Hart, Gus L. W., Curtarolo, Stefano

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