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Title: Structural characterization of heterogeneous RhAu nanoparticles from a microwave-assisted synthesis

Abstract

Heterogeneity in the structure of AuRh nanoparticles, synthesized with a microwave assisted method, is quantified using a combination of experimental methods and theory.

Authors:
 [1]; ORCiD logo [2];  [3]; ORCiD logo [4];  [3];  [5];  [4];  [6]; ORCiD logo [7]; ORCiD logo [2]; ORCiD logo [7]; ORCiD logo [8]
  1. Department of Chemistry and the Institute for Computational Engineering and Sciences, The University of Texas at Austin, Austin, USA
  2. Department of Materials Science and Chemical Engineering, Stony Brook University, Stony Brook, USA
  3. Department of Chemistry, The University of Texas at Austin, Austin, USA
  4. Department of Chemical and Petroleum Engineering, The University of Pittsburgh, Pittsburgh, USA
  5. Texas Materials Institute, The University of Texas at Austin, Austin, USA
  6. Department of Chemical and Petroleum Engineering, The University of Pittsburgh, Pittsburgh, USA, Department of Physics and Astronomy
  7. Texas Materials Institute, The University of Texas at Austin, Austin, USA, Department of Chemistry
  8. Texas Materials Institute, The University of Texas at Austin, Austin, USA, Department of Chemistry and the Institute for Computational Engineering and Sciences
Publication Date:
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
OSTI Identifier:
1483439
Grant/Contract Number:  
SC0012335; SC0012704; AC02-05CH11231
Resource Type:
Journal Article: Publisher's Accepted Manuscript
Journal Name:
Nanoscale
Additional Journal Information:
Journal Name: Nanoscale Journal Volume: 10 Journal Issue: 47; Journal ID: ISSN 2040-3364
Publisher:
Royal Society of Chemistry (RSC)
Country of Publication:
United Kingdom
Language:
English

Citation Formats

Duan, Zhiyao, Timoshenko, Janis, Kunal, Pranaw, House, Stephen D., Wan, Haqin, Jarvis, Karalee, Bonifacio, Cecile, Yang, Judith C., Crooks, Richard M., Frenkel, Anatoly I., Humphrey, Simon M., and Henkelman, Graeme. Structural characterization of heterogeneous RhAu nanoparticles from a microwave-assisted synthesis. United Kingdom: N. p., 2018. Web. doi:10.1039/C8NR04866E.
Duan, Zhiyao, Timoshenko, Janis, Kunal, Pranaw, House, Stephen D., Wan, Haqin, Jarvis, Karalee, Bonifacio, Cecile, Yang, Judith C., Crooks, Richard M., Frenkel, Anatoly I., Humphrey, Simon M., & Henkelman, Graeme. Structural characterization of heterogeneous RhAu nanoparticles from a microwave-assisted synthesis. United Kingdom. doi:10.1039/C8NR04866E.
Duan, Zhiyao, Timoshenko, Janis, Kunal, Pranaw, House, Stephen D., Wan, Haqin, Jarvis, Karalee, Bonifacio, Cecile, Yang, Judith C., Crooks, Richard M., Frenkel, Anatoly I., Humphrey, Simon M., and Henkelman, Graeme. Thu . "Structural characterization of heterogeneous RhAu nanoparticles from a microwave-assisted synthesis". United Kingdom. doi:10.1039/C8NR04866E.
@article{osti_1483439,
title = {Structural characterization of heterogeneous RhAu nanoparticles from a microwave-assisted synthesis},
author = {Duan, Zhiyao and Timoshenko, Janis and Kunal, Pranaw and House, Stephen D. and Wan, Haqin and Jarvis, Karalee and Bonifacio, Cecile and Yang, Judith C. and Crooks, Richard M. and Frenkel, Anatoly I. and Humphrey, Simon M. and Henkelman, Graeme},
abstractNote = {Heterogeneity in the structure of AuRh nanoparticles, synthesized with a microwave assisted method, is quantified using a combination of experimental methods and theory.},
doi = {10.1039/C8NR04866E},
journal = {Nanoscale},
number = 47,
volume = 10,
place = {United Kingdom},
year = {Thu Dec 06 00:00:00 EST 2018},
month = {Thu Dec 06 00:00:00 EST 2018}
}

Journal Article:
Free Publicly Available Full Text
This content will become publicly available on November 27, 2019
Publisher's Accepted Manuscript

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Works referenced in this record:

Projector augmented-wave method
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Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
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Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
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From ultrasoft pseudopotentials to the projector augmented-wave method
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