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Title: Ghost transmission: How large basis sets can make electron transport calculations worse

Authors:
; ; ; ;
Publication Date:
Research Org.:
Energy Frontier Research Centers (EFRC) (United States). Center for Bio-Inspired Energy Science (CBES)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
OSTI Identifier:
1384484
DOE Contract Number:  
SC0000989
Resource Type:
Journal Article
Journal Name:
Journal of Chemical Physics
Additional Journal Information:
Journal Volume: 132; Journal Issue: 2; Related Information: CBES partners with Northwestern University (lead); Harvard University; New York University; Pennsylvania State University; University of Michigan; University of Pittsburgh; Journal ID: ISSN 0021-9606
Publisher:
American Institute of Physics (AIP)
Country of Publication:
United States
Language:
English
Subject:
catalysis (homogeneous), solar (photovoltaic), bio-inspired, charge transport, mesostructured materials, materials and chemistry by design, synthesis (novel materials), synthesis (self-assembly)

Citation Formats

Herrmann, Carmen, Solomon, Gemma C., Subotnik, Joseph E., Mujica, Vladimiro, and Ratner, Mark A. Ghost transmission: How large basis sets can make electron transport calculations worse. United States: N. p., 2010. Web. doi:10.1063/1.3283062.
Herrmann, Carmen, Solomon, Gemma C., Subotnik, Joseph E., Mujica, Vladimiro, & Ratner, Mark A. Ghost transmission: How large basis sets can make electron transport calculations worse. United States. doi:10.1063/1.3283062.
Herrmann, Carmen, Solomon, Gemma C., Subotnik, Joseph E., Mujica, Vladimiro, and Ratner, Mark A. Thu . "Ghost transmission: How large basis sets can make electron transport calculations worse". United States. doi:10.1063/1.3283062.
@article{osti_1384484,
title = {Ghost transmission: How large basis sets can make electron transport calculations worse},
author = {Herrmann, Carmen and Solomon, Gemma C. and Subotnik, Joseph E. and Mujica, Vladimiro and Ratner, Mark A.},
abstractNote = {},
doi = {10.1063/1.3283062},
journal = {Journal of Chemical Physics},
issn = {0021-9606},
number = 2,
volume = 132,
place = {United States},
year = {2010},
month = {1}
}

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