Science of entropy-stabilized ultra-high temperature thin films: Synthesis, validation and properties

Stefano Curtarolo , Cormac Toher , Jon-Paul Maria , Donald Brenner

2017
COMPUTER SIMULATION STUDIES OF WETTING ON HETEROGENEOUS SURFACES

S. CURTAROLO , M. J. BOJAN , G. STAN , M. W. COLE
Proceedings of the Second Pacific Basin Conference 14 -20

2000
otis, A. Cherkasov and A. Tropsha

EN Muratov , J Bajorath , RP Sheridan , IV Tetko
Chem. Soc. Rev 49 3525 -3564

9
2020
Comprehensive Search for New Phases and Compounds in Binary Alloy Systems Based on Platinum-Group Metals, Using a Computational First-Principles Approach

Stefano Curtarolo , Gus L. W. Hart , Thaddeus B. Massalski , Ohad Levy
Physical Review X 3 ( 4) 041035

116
2013
Improved predictions of the physical properties of Zn- and Cd-based wide band-gap semiconductors: a validation of the ACBN0 functional

Stefano Curtarolo , Laalitha S. I. Liyanage , Laalitha S. I. Liyanage , Marco Buongiorno Nardelli
arXiv: Materials Science

63
2015
2
2016
Predicting Superhard Materials via a Machine Learning Informed Evolutionary Structure Search

Stefano Curtarolo , Eva Zurek , Cormac Toher , Davide M. Proserpio
arXiv: Materials Science

66
2019
High-throughput ab initio analysis of the Bi-In, Bi-Mg, Bi-Sb, In-Mg, In-Sb, and Mg-Sb systems

Stefano Curtarolo , Aleksey N. Kolmogorov , Franklin Hadley Cocks
arXiv: Materials Science

52
2005
Metallic glasses for biodegradable implants

Stefano Curtarolo , Cormac Toher , Corey Oses , David Hicks
arXiv: Materials Science

20
2019
Assessing the thermoelectric properties of sintered compounds via high-throughput ab initio calculations

Stefano Curtarolo , Natalio Mingo , Wahyu Setyawan , Zhao Wang
Bulletin of the American Physical Society 2012

208
2012
Machine learning modeling of superconducting critical temperature

Johnpierre Paglione , Stefano Curtarolo , Stefano Curtarolo , Ichiro Takeuchi
npj Computational Materials 4 ( 1) 1 -14

311
2018
High-throughput study of the static dielectric constant at high temperatures in oxide and fluoride cubic perovskites

Ambroise van Roekeghem , Stefano Curtarolo , Natalio Mingo , Jesús Carrete
Physical Review Materials 4 ( 11) 113804

9
2020
On-the-fly closed-loop materials discovery via Bayesian active learning.

Stefano Curtarolo , Leonid A Bendersky , Cormac Toher , Albert V Davydov
Nature Communications 11 ( 1) 5966 -5966

135
2020
AFLOWLIB.ORG: A distributed materials properties repository from high-throughput ab initio calculations

Stefano Curtarolo , Wahyu Setyawan , Shidong Wang , Junkai Xue
Computational Materials Science 58 227 -235

906
2012
AFLOW: An automatic framework for high-throughput materials discovery

Stefano Curtarolo , Wahyu Setyawan , Gus L.W. Hart , Michal Jahnatek
Computational Materials Science 58 218 -226

928
2012
The AFLOW standard for high-throughput materials science calculations

Camilo E Calderon , Jose J Plata , Cormac Toher , Corey Oses
Computational Materials Science 108 233 -238

224
2015
Ordered phases in ruthenium binary alloys from high-throughput first-principles calculations

Gus LW Hart , Lance J Nelson , Michal Jahnátek , Ohad Levy
Physical Review B 84 ( 21) 214110

51
2011
Stable ordered structures of binary technetium alloys from first principles

Ohad Levy , Junkai Xue , Shidong Wang , Gus L. W. Hart
Physical Review B 85 ( 1) 012201

19
2012
Comparative Study of Nonproportionality and Electronic Band Structures Features in Scintillator Materials

Wahyu Setyawan , Romain M. Gaume , Robert S. Feigelson , Stefano Curtarolo
IEEE Transactions on Nuclear Science 56 ( 5) 2989 -2996

82
2009
High-entropy high-hardness metal carbides discovered by entropy descriptors.

Pranab Sarker , Tyler Harrington , Cormac Toher , Corey Oses
Nature Communications 9 ( 1) 4980

487
2018