Publications

X Author: Shreyas Cholia X Term: Applied Energy Materials Group

2025

Horton, Matthew K, Patrick Huck, Ruo Xi Yang, Jason M Munro, Shyam Dwaraknath, Alex M Ganose, Ryan Kingsbury, Mingjian Wen, Jimmy X Shen, Tyler S Mathis, Aaron D Kaplan, Karlo Berket, Janosh Riebesell, Janine George, Andrew S Rosen, Evan W. C Spotte-Smith, Matthew J McDermott, Orion A Cohen, Alex Dunn, Matthew C Kuner, Gian-Marco Rignanese, Guido Petretto, David Waroquiers, Sinead M Griffin, Jeffrey B Neaton, Daryl C Chrzan, Mark D Asta, Geoffroy Hautier, Shreyas Cholia, Gerbrand Ceder, Shyue Ping Ong, Anubhav Jain, and Kristin A Persson."Accelerated data-driven materials science with the Materials Project."Nature Materials 24.10 (2025) 1522-1532. DOI

2016

Olabarriaga, Silvia Delgado, Nancy Wilkins-Diehr, Waleed W Smari, Mohamed Bakhouya, Sandro Fiore, Giovanni Aloisio, Patrick Huck, Daniel Gunter, Shreyas Cholia, Donald Winston, Alpha T N'Diaye, and Kristin A Persson."User applications driven by the community contribution framework MPContribs in the Materials Project."Concurrency and Computation: Practice and Experience 28.7 (2016) 1982 - 1993. DOI

2015

Ong, Shyue P, Shreyas Cholia, Anubhav Jain, Miriam Brafman, Dan Gunter, Gerbrand Ceder, and Kristin A Persson."The Materials Application Programming Interface (API): A simple, flexible and efficient API for materials data based on REpresentational State Transfer (REST) principles."Computational Materials Science 97 (2015) 209-215. DOI

2013

Jain, Anubhav, Shyue P Ong, Geoffroy Hautier, Wei Chen, William D Richards, Stephen T Dacek, Shreyas Cholia, Dan Gunter, David Skinner, Gerbrand Ceder, and Kristin A Persson."Commentary: The Materials Project: A materials genome approach to accelerating materials innovation."APL Materials 1.1 (2013). DOI
Ong, Shyue P, William D Richards, Anubhav Jain, Geoffroy Hautier, Michael Kocher, Shreyas Cholia, Dan Gunter, Vincent L Chevrier, Kristin A Persson, and Gerbrand Ceder."Python Materials Genomics (pymatgen): A robust, open-source python library for materials analysis."Computational Materials Science 68 (2013) 314-319. DOI

2012

Gunter, Dan, Shreyas Cholia, Anubhav Jain, Michael Kocher, Kristin A Persson, Lavanya Ramakrishnan, Shyue P Ong, and Gerbrand Ceder."Community Accessible Datastore of High-Throughput Calculations: Experiences from the Materials Project."High Performance Computing, Networking, Storage and Analysis (SCC) 2012 (2012) 1244-1251. DOI