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Title: First principles modeling of the temperature dependent ternary phase diagram for the Cu-Pd-S system

Authors:
; ;
Publication Date:
Research Org.:
National Energy Technology Lab. (NETL), Pittsburgh, PA, and Morgantown, WV (United States). In-house Research
Sponsoring Org.:
USDOE Office of Fossil Energy (FE)
OSTI Identifier:
1165435
Report Number(s):
A-UNIV-PUB-077
Journal ID: ISSN 0927-0256
DOE Contract Number:  
DE-FE0004000
Resource Type:
Journal Article
Resource Relation:
Journal Name: Computational Materials Science; Journal Volume: 92
Country of Publication:
United States
Language:
English
Subject:
Bulk sulfidization; Sulfidization threshholds; First principles calculations; Phase stability; Phase diagram; Pd16S7; Pd4S; CuPdS

Citation Formats

Huhn, William Paul, Widom, Michael, and Gao, Michael C. First principles modeling of the temperature dependent ternary phase diagram for the Cu-Pd-S system. United States: N. p., 2014. Web. doi:10.1016/j.commatsci.2014.05.065.
Huhn, William Paul, Widom, Michael, & Gao, Michael C. First principles modeling of the temperature dependent ternary phase diagram for the Cu-Pd-S system. United States. doi:10.1016/j.commatsci.2014.05.065.
Huhn, William Paul, Widom, Michael, and Gao, Michael C. Mon . "First principles modeling of the temperature dependent ternary phase diagram for the Cu-Pd-S system". United States. doi:10.1016/j.commatsci.2014.05.065.
@article{osti_1165435,
title = {First principles modeling of the temperature dependent ternary phase diagram for the Cu-Pd-S system},
author = {Huhn, William Paul and Widom, Michael and Gao, Michael C},
abstractNote = {},
doi = {10.1016/j.commatsci.2014.05.065},
journal = {Computational Materials Science},
number = ,
volume = 92,
place = {United States},
year = {Mon Sep 01 00:00:00 EDT 2014},
month = {Mon Sep 01 00:00:00 EDT 2014}
}