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Title: Sequential-Optimization-Based Framework for Robust Modeling and Design of Heterogeneous Catalytic Systems

Authors:
 [1]; ORCiD logo [1]; ORCiD logo [1]
  1. Department of Chemical &, Biological Engineering, University of Wisconsin-Madison, Madison, Wisconsin 53706, United States
Publication Date:
Research Org.:
Univ. of Wisconsin-Madison, Madison, WI (United States)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
OSTI Identifier:
1408149
Alternate Identifier(s):
OSTI ID: 1421604; OSTI ID: 1507711
Grant/Contract Number:  
FG02-05ER15731
Resource Type:
Journal Article: Published Article
Journal Name:
Journal of Physical Chemistry. C
Additional Journal Information:
Journal Name: Journal of Physical Chemistry. C Journal Volume: 121 Journal Issue: 46; Journal ID: ISSN 1932-7447
Publisher:
American Chemical Society
Country of Publication:
United States
Language:
English
Subject:
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY

Citation Formats

Rangarajan, Srinivas, Maravelias, Christos T., and Mavrikakis, Manos. Sequential-Optimization-Based Framework for Robust Modeling and Design of Heterogeneous Catalytic Systems. United States: N. p., 2017. Web. doi:10.1021/acs.jpcc.7b08089.
Rangarajan, Srinivas, Maravelias, Christos T., & Mavrikakis, Manos. Sequential-Optimization-Based Framework for Robust Modeling and Design of Heterogeneous Catalytic Systems. United States. doi:10.1021/acs.jpcc.7b08089.
Rangarajan, Srinivas, Maravelias, Christos T., and Mavrikakis, Manos. Thu . "Sequential-Optimization-Based Framework for Robust Modeling and Design of Heterogeneous Catalytic Systems". United States. doi:10.1021/acs.jpcc.7b08089.
@article{osti_1408149,
title = {Sequential-Optimization-Based Framework for Robust Modeling and Design of Heterogeneous Catalytic Systems},
author = {Rangarajan, Srinivas and Maravelias, Christos T. and Mavrikakis, Manos},
abstractNote = {},
doi = {10.1021/acs.jpcc.7b08089},
journal = {Journal of Physical Chemistry. C},
issn = {1932-7447},
number = 46,
volume = 121,
place = {United States},
year = {2017},
month = {11}
}

Journal Article:
Free Publicly Available Full Text
Publisher's Version of Record at 10.1021/acs.jpcc.7b08089

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Cited by: 2 works
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Works referencing / citing this record:

Predicting CO 2 adsorption and reactivity on transition metal surfaces using popular density functional theory methods
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Predicting CO 2 adsorption and reactivity on transition metal surfaces using popular density functional theory methods
journal, June 2019