Zobrazeno 1 - 6
of 6
pro vyhledávání: '"Brian Rohr"'
Autor:
Sathya R. Chitturi, Akash Ramdas, Yue Wu, Brian Rohr, Stefano Ermon, Jennifer Dionne, Felipe H. da Jornada, Mike Dunne, Christopher Tassone, Willie Neiswanger, Daniel Ratner
Publikováno v:
npj Computational Materials, Vol 10, Iss 1, Pp 1-12 (2024)
Abstract Rapid discovery and synthesis of future materials requires intelligent data acquisition strategies to navigate large design spaces. A popular strategy is Bayesian optimization, which aims to find candidates that maximize material properties;
Externí odkaz:
https://doaj.org/article/392b6cf994d2442fa62f48bcd95108a5
Materials knowledge is inherently hierarchical. While high-level descriptors such as composition and structure are valuable for contextualizing materials data, the data must ultimately be considered in the context of its low-level acquisition details
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::3bc436370be11ed5d9ccba615115cbad
https://doi.org/10.26434/chemrxiv-2023-md55t
https://doi.org/10.26434/chemrxiv-2023-md55t
Autor:
Michael Statt, Kristopher Brown, Santosh Suram, Linda Hung, Daniel Schweigert, John Gregoire, Brian Rohr
In this work, we present DBgen, a Python library that provides a framework for defining extract-transform-load (ETL) pipelines to create and populate SQL databases. DBgen is most useful when the underlying data has complex relationships, requires mul
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::7df1801ba093c05164a73c1be5e9b9d9
https://doi.org/10.26434/chemrxiv-2021-34p7f
https://doi.org/10.26434/chemrxiv-2021-34p7f
Autor:
Linda Hung, Santosh Suram, Junko Yano, Yang Ha, Joseph H. Montoya, Brian Rohr, Matthew Carbone, Steven Torrisi
X-ray absorption spectroscopy (XAS) produces a wealth of information about the local structure of materials, but interpretation of spectra often relies on easily accessible trends and prior assumptions about the structure. Recently, researchers have
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::80b164824e1de4aa4f9c82fce921463c
https://doi.org/10.26434/chemrxiv.11873691
https://doi.org/10.26434/chemrxiv.11873691
Autor:
Ifan Stephens, Aayush Singh, Brian Rohr, Sarah Blair, Stefano Mezzavilla, Jakob Kibsgaard, Peter Christian Kjærgaard Vesborg, Matteo Cargnello, Stacey Bent, Thomas Jaramillo, Jens Kehlet Nørskov, Suzanne Zamany Andersen, Chorkendorff, Viktor Čolić, Sungeun Yang, John Schwalbe, Adam Nielander, Joshua McEnaney, Kasper Enemark-Rasmussen, Jon Baker
Publikováno v:
Technical University of Denmark Orbit
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=dedup_wf_001::3747dbd9ab94747a1fe5c7fb36830a9c
https://orbit.dtu.dk/en/publications/4cd877a9-235e-4e9c-834b-4ced0d273d26
https://orbit.dtu.dk/en/publications/4cd877a9-235e-4e9c-834b-4ced0d273d26
Autor:
John Schwalbe, Aayush Singh, Brian Rohr, Michael Statt, Adam Nielander, Joshua McEnaney, Suzanne Zamany Andersen, Viktor Čolić, Sungeun Yang, Chorkendorff, Thomas Jaramillo, Jens Nørskov, Matteo Cargnello
Publikováno v:
Technical University of Denmark Orbit
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=dedup_wf_001::8e147612856922a484b11fa3ad3cb900
https://orbit.dtu.dk/en/publications/1ff81cb8-17d2-4daf-9ce1-c7e97aa21cfd
https://orbit.dtu.dk/en/publications/1ff81cb8-17d2-4daf-9ce1-c7e97aa21cfd