Local Chemical Ordering and Negative Thermal Expansion in PtNi Alloy Nanoparticles
Abstract
An atomic insight into the local chemical ordering and lattice strain is particular interesting to recent emerging bimetallic nanocatalysts such as PtNi alloys. Here in this paper, we reported the atomic distribution, chemical environment and lattice thermal evolution in full-scale structural description of PtNi alloy nanoparticles (NPs). The different segregation of elements in the well-faceted PtNi nanoparticles is convinced by extended X-ray absorption fine structure (EXAFS). Atomic pair distribution function (PDF) study evidences the co-existence of the face-centered cubic and tetragonal ordering parts in the local environment of PtNi nanoparticles. Further reverse monte carlo (RMC) simulation with PDF data obviously exposed the segregation as Ni and Pt in the centers of {111} and {001} facets respectively. Layer-by-layer statistical analysis up to 6 nm for the local atomic pairs revealed the distribution of local tetragonal ordering on the surface. This local coordination environment facilitates the distribution of heteroatomic Pt-Ni pairs, which plays an important role in the negative thermal expansion of Pt41Ni59 NPs. The present study on PtNi alloy NPs from local short-range coordination to long-range average lattice provides a new perspective on tailoring physical properties in nanomaterials.
- Authors:
-
- Univ. of Science and Technology Beijing, Beijing (China). Dept. of Physical Chemistry
- Chinese Academy of Sciences (CAS), Beijing (China). Beijing Synchrotron Radiation Facility, Inst. of High Energy Physics
- Argonne National Lab. (ANL), Argonne, IL (United States). X-Ray Science Division
- Publication Date:
- Research Org.:
- Argonne National Lab. (ANL), Argonne, IL (United States)
- Sponsoring Org.:
- National Natural Science Foundation of China (NSFC); USDOE Office of Science (SC), Basic Energy Sciences (BES). Scientific User Facilities Division
- OSTI Identifier:
- 1467893
- Grant/Contract Number:
- AC02-06CH11357
- Resource Type:
- Accepted Manuscript
- Journal Name:
- Nano Letters
- Additional Journal Information:
- Journal Volume: 17; Journal Issue: 12; Journal ID: ISSN 1530-6984
- Publisher:
- American Chemical Society
- Country of Publication:
- United States
- Language:
- English
- Subject:
- 36 MATERIALS SCIENCE; 77 NANOSCIENCE AND NANOTECHNOLOGY; PtNi alloy nanoparticles; extended X-ray absorption fine structure; atomic pair distribution function; negative thermal expansion; local ordering
Citation Formats
Li, Qiang, Zhu, He, Zheng, Lirong, Fan, Longlong, Wang, Na, Rong, Yangchun, Ren, Yang, Chen, Jun, Deng, Jinxia, and Xing, Xianran. Local Chemical Ordering and Negative Thermal Expansion in PtNi Alloy Nanoparticles. United States: N. p., 2017.
Web. doi:10.1021/acs.nanolett.7b04219.
Li, Qiang, Zhu, He, Zheng, Lirong, Fan, Longlong, Wang, Na, Rong, Yangchun, Ren, Yang, Chen, Jun, Deng, Jinxia, & Xing, Xianran. Local Chemical Ordering and Negative Thermal Expansion in PtNi Alloy Nanoparticles. United States. https://doi.org/10.1021/acs.nanolett.7b04219
Li, Qiang, Zhu, He, Zheng, Lirong, Fan, Longlong, Wang, Na, Rong, Yangchun, Ren, Yang, Chen, Jun, Deng, Jinxia, and Xing, Xianran. Tue .
"Local Chemical Ordering and Negative Thermal Expansion in PtNi Alloy Nanoparticles". United States. https://doi.org/10.1021/acs.nanolett.7b04219. https://www.osti.gov/servlets/purl/1467893.
@article{osti_1467893,
title = {Local Chemical Ordering and Negative Thermal Expansion in PtNi Alloy Nanoparticles},
author = {Li, Qiang and Zhu, He and Zheng, Lirong and Fan, Longlong and Wang, Na and Rong, Yangchun and Ren, Yang and Chen, Jun and Deng, Jinxia and Xing, Xianran},
abstractNote = {An atomic insight into the local chemical ordering and lattice strain is particular interesting to recent emerging bimetallic nanocatalysts such as PtNi alloys. Here in this paper, we reported the atomic distribution, chemical environment and lattice thermal evolution in full-scale structural description of PtNi alloy nanoparticles (NPs). The different segregation of elements in the well-faceted PtNi nanoparticles is convinced by extended X-ray absorption fine structure (EXAFS). Atomic pair distribution function (PDF) study evidences the co-existence of the face-centered cubic and tetragonal ordering parts in the local environment of PtNi nanoparticles. Further reverse monte carlo (RMC) simulation with PDF data obviously exposed the segregation as Ni and Pt in the centers of {111} and {001} facets respectively. Layer-by-layer statistical analysis up to 6 nm for the local atomic pairs revealed the distribution of local tetragonal ordering on the surface. This local coordination environment facilitates the distribution of heteroatomic Pt-Ni pairs, which plays an important role in the negative thermal expansion of Pt41Ni59 NPs. The present study on PtNi alloy NPs from local short-range coordination to long-range average lattice provides a new perspective on tailoring physical properties in nanomaterials.},
doi = {10.1021/acs.nanolett.7b04219},
journal = {Nano Letters},
number = 12,
volume = 17,
place = {United States},
year = {Tue Nov 21 00:00:00 EST 2017},
month = {Tue Nov 21 00:00:00 EST 2017}
}
Web of Science
Works referenced in this record:
Morphology and Phase Controlled Construction of Pt–Ni Nanostructures for Efficient Electrocatalysis
journal, March 2016
- Ding, Jiabao; Bu, Lingzheng; Guo, Shaojun
- Nano Letters, Vol. 16, Issue 4
High-performance transition metal-doped Pt3Ni octahedra for oxygen reduction reaction
journal, June 2015
- Huang, X.; Zhao, Z.; Cao, L.
- Science, Vol. 348, Issue 6240
Syntheses of Water-Soluble Octahedral, Truncated Octahedral, and Cubic Pt–Ni Nanocrystals and Their Structure–Activity Study in Model Hydrogenation Reactions
journal, May 2012
- Wu, Yuen; Cai, Shuangfei; Wang, Dingsheng
- Journal of the American Chemical Society, Vol. 134, Issue 21
Synthesis and Oxygen Reduction Activity of Shape-Controlled Pt 3 Ni Nanopolyhedra
journal, February 2010
- Zhang, Jun; Yang, Hongzhou; Fang, Jiye
- Nano Letters, Vol. 10, Issue 2
Negative Thermal Expansion Coefficient of Graphene Measured by Raman Spectroscopy
journal, August 2011
- Yoon, Duhee; Son, Young-Woo; Cheong, Hyeonsik
- Nano Letters, Vol. 11, Issue 8
Thermal Contraction of Au Nanoparticles
journal, September 2002
- Li, W. -H.; Wu, S. Y.; Yang, C. C.
- Physical Review Letters, Vol. 89, Issue 13
Giant negative thermal expansion in magnetic nanocrystals
journal, October 2008
- Zheng, X. G.; Kubozono, H.; Yamada, H.
- Nature Nanotechnology, Vol. 3, Issue 12
Unusual Transformation from Strong Negative to Positive Thermal Expansion in Perovskite
journal, March 2013
- Chen, Jun; Fan, Longlong; Ren, Yang
- Physical Review Letters, Vol. 110, Issue 11
Anomalous Magnetic Properties of Nanoparticles Arising from Defect Structures: Topotaxial Oxidation of Fe 1– x O|Fe 3−δ O 4 Core|Shell Nanocubes to Single-Phase Particles
journal, July 2013
- Wetterskog, Erik; Tai, Cheuk-Wai; Grins, Jekabs
- ACS Nano, Vol. 7, Issue 8
Local Structural Distortion Induced Uniaxial Negative Thermal Expansion in Nanosized Semimetal Bismuth
journal, June 2016
- Li, Qiang; Zhu, He; Zheng, Lirong
- Advanced Science, Vol. 3, Issue 11
Surface dangling bonds are a cause of B-type blinking in Si nanoparticles
journal, January 2015
- Brawand, Nicholas P.; Vörös, Márton; Galli, Giulia
- Nanoscale, Vol. 7, Issue 8
The surface science of nanocrystals
journal, January 2016
- Boles, Michael A.; Ling, Daishun; Hyeon, Taeghwan
- Nature Materials, Vol. 15, Issue 2
Hydration and Thermal Expansion in Anatase Nanoparticles
journal, June 2016
- Zhu, He; Li, Qiang; Ren, Yang
- Advanced Materials, Vol. 28, Issue 32
Realignment of Nanocrystal Aggregates into Single Crystals as a Result of Inherent Surface Stress
journal, July 2016
- Liu, Zhaoming; Pan, Haihua; Zhu, Genxing
- Angewandte Chemie International Edition, Vol. 55, Issue 41
Negative thermal expansion in functional materials: controllable thermal expansion by chemical modifications
journal, January 2015
- Chen, Jun; Hu, Lei; Deng, Jinxia
- Chemical Society Reviews, Vol. 44, Issue 11
Monte Carlo simulations of segregation in Pt-Ni catalyst nanoparticles
journal, January 2005
- Wang, Guofeng; Van Hove, M. A.; Ross, P. N.
- The Journal of Chemical Physics, Vol. 122, Issue 2
Synthesis, electrochemical characterization and molecular dynamics studies of surface segregation of platinum nano-alloy electrocatalysts
journal, January 2011
- Favry, E.; Wang, D.; Fantauzzi, D.
- Physical Chemistry Chemical Physics, Vol. 13, Issue 20
Improved Oxygen Reduction Activity on Pt3Ni(111) via Increased Surface Site Availability
journal, January 2007
- Stamenkovic, V. R.; Fowler, B.; Mun, B. S.
- Science, Vol. 315, Issue 5811, p. 493-497
Trends in electrocatalysis on extended and nanoscale Pt-bimetallic alloy surfaces
journal, February 2007
- Stamenkovic, Vojislav R.; Mun, Bongjin Simon; Arenz, Matthias
- Nature Materials, Vol. 6, Issue 3, p. 241-247
Compositional segregation in shaped Pt alloy nanoparticles and their structural behaviour during electrocatalysis
journal, June 2013
- Cui, Chunhua; Gan, Lin; Heggen, Marc
- Nature Materials, Vol. 12, Issue 8
Atomic Structure of Pt 3 Ni Nanoframe Electrocatalysts by in Situ X-ray Absorption Spectroscopy
journal, December 2015
- Becknell, Nigel; Kang, Yijin; Chen, Chen
- Journal of the American Chemical Society, Vol. 137, Issue 50
Structure of Pt n Ni Nanoparticles Electrocatalysts Investigated by X-ray Absorption Spectroscopy
journal, September 2013
- Bao, Hongliang; Li, Jiong; Jiang, Luhua
- The Journal of Physical Chemistry C, Vol. 117, Issue 40
Electrochemical Activation of CO 2 through Atomic Ordering Transformations of AuCu Nanoparticles
journal, June 2017
- Kim, Dohyung; Xie, Chenlu; Becknell, Nigel
- Journal of the American Chemical Society, Vol. 139, Issue 24
Solvothermal Synthesis of Platinum Alloy Nanoparticles for Oxygen Reduction Electrocatalysis
journal, May 2012
- Carpenter, Michael K.; Moylan, Thomas E.; Kukreja, Ratandeep Singh
- Journal of the American Chemical Society, Vol. 134, Issue 20
Thermodynamic properties of Pt nanoparticles: Size, shape, support, and adsorbate effects
journal, December 2011
- Roldan Cuenya, B.; Alcántara Ortigoza, M.; Ono, L. K.
- Physical Review B, Vol. 84, Issue 24
Role of Support–Nanoalloy Interactions in the Atomic-Scale Structural and Chemical Ordering for Tuning Catalytic Sites
journal, August 2012
- Yang, Lefu; Shan, Shiyao; Loukrakpam, Rameshwori
- Journal of the American Chemical Society, Vol. 134, Issue 36
Size-Dependent Spontaneous Alloying of Au−Ag Nanoparticles
journal, October 2002
- Shibata, Tomohiro; Bunker, Bruce A.; Zhang, Zhenyuan
- Journal of the American Chemical Society, Vol. 124, Issue 40
Wavelet analysis of extended x-ray absorption fine structure data
journal, March 2005
- Funke, H.; Scheinost, A. C.; Chukalina, M.
- Physical Review B, Vol. 71, Issue 9
Structural Models and Atomic Distribution of Bimetallic Nanoparticles as Investigated by X-ray Absorption Spectroscopy
journal, August 2005
- Hwang, Bing-Joe; Sarma, Loka Subramanyam; Chen, Jiun-Ming
- Journal of the American Chemical Society, Vol. 127, Issue 31
The surface structure of silver-coated gold nanocrystals and its influence on shape control
journal, July 2015
- Padmos, J. Daniel; Personick, Michelle L.; Tang, Qing
- Nature Communications, Vol. 6, Issue 1
Comparative investigation of structural and transport properties of L1 0 NiPt and CoPt phases; the role of magnetism
journal, September 1988
- Leroux, C.; Cadeville, M. C.; Pierron-Bohnes, V.
- Journal of Physics F: Metal Physics, Vol. 18, Issue 9
Monodisperse FePt Nanoparticles and Ferromagnetic FePt Nanocrystal Superlattices
journal, March 2000
- Sun, S.
- Science, Vol. 287, Issue 5460
Surface-sandwich segregation on nondilute bimetallic alloys: and probed by low-energy electron diffraction
journal, May 1985
- Gauthier, Y.; Joly, Y.; Baudoing, R.
- Physical Review B, Vol. 31, Issue 10
Structural Evolution of Sub-10 nm Octahedral Platinum–Nickel Bimetallic Nanocrystals
journal, May 2017
- Chang, Qiaowan; Xu, Yuan; Duan, Zhiyuan
- Nano Letters, Vol. 17, Issue 6
Works referencing / citing this record:
Reverse Monte Carlo modeling for local structures of noble metal nanoparticles using high-energy XRD and EXAFS
journal, January 2019
- Harada, Masafumi; Ikegami, Risa; Kumara, Loku Singgappulige Rosantha
- RSC Advances, Vol. 9, Issue 51
One-Pot Synthesis of Highly Efficient Carbon-Supported Polyhedral Pt3Ni Alloy Nanoparticles for Oxygen Reduction Reaction
journal, August 2019
- Liu, Yongqiang; Chen, Hongming; Tian, Chongchong
- Electrocatalysis, Vol. 10, Issue 6
Cone-spiral magnetic ordering dominated lattice distortion and giant negative thermal expansion in Fe-doped MnNiGe compounds
journal, January 2020
- Shen, Feiran; Zhou, Houbo; Hu, Fengxia
- Materials Horizons, Vol. 7, Issue 3