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Publications

Search Publications by

Marcus William Newrock (Fed)

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Displaying 1 - 8 of 8

Computational screening of high-performance optoelectronic materials using OptB88vdW and TB-mBJ formalisms

May 8, 2018
Author(s)
Kamal Choudhary, Qin Zhang, Sugata Chowdhury, Nhan V. Nguyen, Zachary T. Trautt, Marcus W. Newrock, Faical Y. Congo, Andrew C. Reid, Francesca M. Tavazza
We perform high-throughput density functional theory (DFT) calculations for optoelectronic properties (electronic bandgap and frequency dependent dielectric function) using the OptB88vdW functional (OPT) and the Tran-Blaha modified Becke Johnson potential

Software Requirements Specification to Distribute Manufacturing Data

December 18, 2017
Author(s)
Thomas D. Hedberg, Moneer M. Helu, Marcus W. Newrock
The purpose of this document is to describe the requirements specifications for applications and a data repository to distribute manufacturing data. Prospective developers, technical-assessment personnel, and interested end-users are the intended audience

An Informatics Infrastructure for the Materials Genome Initiative

July 6, 2016
Author(s)
Alden A. Dima, Sunil K. Bhaskarla, Chandler A. Becker, Mary C. Brady, Carelyn E. Campbell, Philippe J. Dessauw, Robert J. Hanisch, Ursula R. Kattner, Kenneth G. Kroenlein, Adele P. Peskin, Raymond L. Plante, Guillaume Sousa Amaral, Zachary T. Trautt, James A. Warren, Sharief S. Youssef, Sheng Yen Li, Pierre Francois Rigodiat, Marcus W. Newrock
A materials data infrastructure that enables the sharing and transformation of a wide range of materials data is an essential part of achieving the goals of the Materials Genome Initiative. We describe two high-level requirements of such an infrastructure

Initiating Mobile Software Development - Lessons Learned From a 12-Month Project

December 30, 2011
Author(s)
Frederic J. de Vaulx, Paul Khouri Saba, Marcus W. Newrock, Bertrand C. Stivalet
As mobile devices’ capabilities keep on improving, today’s mobile software ecosystem evolves at an unprecedented speed. This evolution makes mobile software development more common and critical. Moreover, the ever-increasing number of new development