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Title: An automated analysis workflow for optimization of force-field parameters using neutron scattering data

Authors:
ORCiD logo ; ORCiD logo ; ORCiD logo ; ; ; ORCiD logo ;
Publication Date:
Grant/Contract Number:
SC0012636; AC05-00OR22725
Type:
Publisher's Accepted Manuscript
Journal Name:
Journal of Computational Physics
Additional Journal Information:
Journal Volume: 340; Journal Issue: C; Related Information: CHORUS Timestamp: 2018-09-03 01:55:11; Journal ID: ISSN 0021-9991
Publisher:
Elsevier
Sponsoring Org:
USDOE
Country of Publication:
United States
Language:
English
OSTI Identifier:
1396729

Lynch, Vickie E., Borreguero, Jose M., Bhowmik, Debsindhu, Ganesh, Panchapakesan, Sumpter, Bobby G., Proffen, Thomas E., and Goswami, Monojoy. An automated analysis workflow for optimization of force-field parameters using neutron scattering data. United States: N. p., Web. doi:10.1016/j.jcp.2017.03.045.
Lynch, Vickie E., Borreguero, Jose M., Bhowmik, Debsindhu, Ganesh, Panchapakesan, Sumpter, Bobby G., Proffen, Thomas E., & Goswami, Monojoy. An automated analysis workflow for optimization of force-field parameters using neutron scattering data. United States. doi:10.1016/j.jcp.2017.03.045.
Lynch, Vickie E., Borreguero, Jose M., Bhowmik, Debsindhu, Ganesh, Panchapakesan, Sumpter, Bobby G., Proffen, Thomas E., and Goswami, Monojoy. 2017. "An automated analysis workflow for optimization of force-field parameters using neutron scattering data". United States. doi:10.1016/j.jcp.2017.03.045.
@article{osti_1396729,
title = {An automated analysis workflow for optimization of force-field parameters using neutron scattering data},
author = {Lynch, Vickie E. and Borreguero, Jose M. and Bhowmik, Debsindhu and Ganesh, Panchapakesan and Sumpter, Bobby G. and Proffen, Thomas E. and Goswami, Monojoy},
abstractNote = {},
doi = {10.1016/j.jcp.2017.03.045},
journal = {Journal of Computational Physics},
number = C,
volume = 340,
place = {United States},
year = {2017},
month = {7}
}