Fritz Haber Institute of the Max Planck Society

Publications of Stefano Curtarolo

All genres

Journal Article (15)

2019

Journal Article

Alberi, Kirstin, Marco Buongiorno Nardelli, Andriy Zakutayev, Lubos Mitas, Stefano Curtarolo, Anubhav Jain, Marco Fornari, Nicola Marzari, Ichiro Takeuchi, Martin L. Green, Mercouri Kanatzidis, Mike F. Toney, Sergiy Butenko, Bryce Meredig, Stephan Lany, Ursula R. Kattner, Albert Davydov, Eric S. Toberer, Vladan Stevanovic, Aron Walsh, Nam-Gyu Park, Alán Aspuru-Guzik, Daniel P. Tabor, Jenny Nelson, James Murphy, Anant Setlur, John Gregoire, Hong Li, Ruijuan Xiao, Alfred Ludwig, Lane W. Martin, Andrew M. Rappe, Su-Huai Wei and John Perkins: The 2019 materials by design roadmap.

MPG.PuRe

publisher-version

Journal Article

Friedrich, Rico, Demet Usanmaz, Corey Oses, Andrew Supka, Marco Fornari, Marco Buongiorno Nardelli, Cormac Toher and Stefano Curtarolo: Coordination corrected ab initio formation enthalpies.

MPG.PuRe

publisher-version

Journal Article

Hicks, David, Michael J. Mehl, Eric Gossett, Cormac Toher, Ohad Levy, Robert M. Hanson, Gus Hart and Stefano Curtarolo: The AFLOW Library of Crystallographic Prototypes: Part 2.

MPG.PuRe

Journal Article

Nath, Pinku, Demet Usanmaz, David Hicks, Corey Oses, Marco Fornari, Marco Buongiorno Nardelli, Cormac Toher and Stefano Curtarolo: AFLOW-QHA3P: Robust and automated method to compute thermodynamic properties of solids.

MPG.PuRe

publisher-version

2018

Journal Article

Gossett, Eric, Cormac Toher, Corey Oses, Olexandr Isayev, Fleur Legrain, Frisco Rose, Eva Zurek, Jesús Carrete, Natalio Mingo, Alexander Tropsha and Stefano Curtarolo: AFLOW-ML: A RESTful API for machine-learning predictions of materials properties.

MPG.PuRe

Journal Article

Hever, Alon, Corey Oses, Stefano Curtarolo, Ohad Levy and Amir Natan: The Structure and Composition Statistics of 6A Binary and Ternary Crystalline Materials.

MPG.PuRe

Journal Article

Hicks, David, Corey Oses, Eric Gossett, Geena Gomez, Richard H. Taylor, Cormac Toher, Michael J. Mehl, Ohad Levy and Stefano Curtarolo: AFLOW-SYM: platform for the complete, automatic and self-consistent symmetry analysis of crystals.

MPG.PuRe

Journal Article

Lederer, Yoav, Cormac Toher, Kenneth S. Vecchio and Stefano Curtarolo: The search for high entropy alloys: A high-throughput ab-initio approach.

MPG.PuRe

Journal Article

Legrain, Fleur, Amboise van Roekeghem, Stefano Curtarolo, Jesus Carrete, Georg K.H. Madsen and Natalio Mingo: Vibrational Properties of Metastable Polymorph Structures by Machine Learning.

MPG.PuRe

Journal Article

Nardelli, Marco Buongiorno, Frank T. Cerasoli, Marcio Costa, Stefano Curtarolo, Riccardo De Gennaro, Marco Fornari, Laalitha Liyanage, Andrew R. Supka and Haihang Wang: PAOFLOW: A utility to construct and operate on ab initio Hamiltonians from the projections of electronic wavefunctions on atomic orbital bases, including characterization of topological materials.

MPG.PuRe

Journal Article

Oses, Corey, Eric Gossett, David Hicks, Frisco Rose, Michael J. Mehl, Eric Perim, Ichiro Takeuchi, Stefano Sanvito, Matthias Scheffler, Yoav Lederer, Ohad Levy, Cormac Toher and Stefano Curtarolo: AFLOW-CHULL: Cloud-Oriented Platform for Autonomous Phase Stability Analysis.

MPG.PuRe

Journal Article

Ouyang, Runhai, Stefano Curtarolo, Emre Ahmetcik, Matthias Scheffler and Luca M. Ghiringhelli: SISSO: a compressed-sensing method for identifying the best low-dimensional descriptor in an immensity of offered candidates.

MPG.PuRe

supplementary-material

publisher-version

Journal Article

Sarker, Pranab, Tyler Harrington, Cormac Toher, Corey Oses, Mojtaba Samiee, Jon-Paul Maria, Donald W. Brenner, Kenneth S. Vecchio and Stefano Curtarolo: High-entropy high-hardness metal carbides discovered by entropy descriptors.

MPG.PuRe

publisher-version

Journal Article

Stanev, Valentin, Corey Oses, A.Gilad Kusne, Efrain Rodriguez, Johnpierre Paglione, Stefano Curtarolo and Ichiro Takeuchi: Machine learning modeling of superconducting critical temperature.

MPG.PuRe

publisher-version

Journal Article

Usanmaz, Demet, Pinku Nath, Cormac Toher, Jose Javier Plata, Rico Friedrich, Marco Fornari, Marco Buongiorno Nardelli and Stefano Curtarolo: Spinodal Superlattices of Topological Insulators.

MPG.PuRe