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5 results in Authors: Brian A. Rohr

Theoretical and Computational Chemistry

Random Forest Machine Learning Models for Interpretable X-Ray Absorption Near-Edge Structure Spectrum-Property Relationships

Steven Torrisi, Matthew Carbone, Brian Rohr, Joseph H. Montoya, Yang Ha, Junko Yano, Santosh Suram, Linda Hung

Version 1 posted 20 February 2020

753

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Materials Science

A Simple Linear Relation Solves Unphysical DFT Energy Corrections

Brian Rohr, Santosh Suram, Jens Bakander

Version 1 posted 05 November 2024

157

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Materials Science

ESAMP: Event-Sourced Architecture for Materials Provenance Management and Application to Accelerated Materials Discovery

Michael Statt, Brian A. Rohr, Kris S. Brown, Dan Guevarra, Jens Strabo Hummelshøj, Linda Hung, abraham anapolsky, John Gregoire, Santosh Suram

Version 2 posted 10 May 2023

515

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1

Citations

Materials Science

The Materials Experiment Knowledge Graph

Michael Statt, Brian Rohr, Dan Guevarra, Ja'Nya Breeden, Santosh Suram, John Gregoire

Version 1 posted 19 April 2023

414

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Materials Science

DBgen: A Python Library for Defining Scalable, Maintainable, Accessible, Reconfigurable, Transparent (SMART) Data Pipelines

Michael Statt, Kristopher Brown, Santosh Suram, Linda Hung, Daniel Schweigert, John Gregoire, Brian Rohr

Version 1 posted 30 July 2021

447

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