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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:
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
OSTI Identifier:
1396729
Grant/Contract Number:  
SC0012636; AC05-00OR22725; AC02-05CH11231
Resource Type:
Journal Article: Publisher's Accepted Manuscript
Journal Name:
Journal of Computational Physics
Additional Journal Information:
Journal Volume: 340; Journal Issue: C; Related Information: CHORUS Timestamp: 2017-10-04 15:17:04; Journal ID: ISSN 0021-9991
Publisher:
Elsevier
Country of Publication:
United States
Language:
English

Citation Formats

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., 2017. 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. Sat . "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 = {Sat Jul 01 00:00:00 EDT 2017},
month = {Sat Jul 01 00:00:00 EDT 2017}
}

Journal Article:
Free Publicly Available Full Text
Publisher's Version of Record at 10.1016/j.jcp.2017.03.045

Citation Metrics:
Cited by: 2 works
Citation information provided by
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