skip to main content
DOE PAGES title logo U.S. Department of Energy
Office of Scientific and Technical Information

This content will become publicly available on July 29, 2020

Title: Water-Mediated Surface Diffusion Mechanism Enables the Cold Sintering Process: A Combined Computational and Experimental Study

Authors:
ORCiD logo [1];  [2];  [1]; ORCiD logo [3]
  1. Materials Research Institute, The Pennsylvania State University, University Park PA 16802 USA
  2. Materials Research Institute, The Pennsylvania State University, University Park PA 16802 USA, State Key Laboratory for Mechanical Behaviour of Materials, School of Materials Science and Engineering, Xi'an Jiaotong University, Xi'an China
  3. Materials Research Institute, The Pennsylvania State University, University Park PA 16802 USA, Department of Mechanical Engineering, The Pennsylvania State University, University Park PA 16802 USA
Publication Date:
Sponsoring Org.:
USDOE
OSTI Identifier:
1559059
Grant/Contract Number:  
MUSE EFRC
Resource Type:
Publisher's Accepted Manuscript
Journal Name:
Angewandte Chemie (International Edition)
Additional Journal Information:
Journal Name: Angewandte Chemie (International Edition) Journal Volume: 58 Journal Issue: 36; Journal ID: ISSN 1433-7851
Publisher:
Wiley Blackwell (John Wiley & Sons)
Country of Publication:
Germany
Language:
English

Citation Formats

Sengul, Mert Y., Guo, Jing, Randall, Clive A., and van Duin, Adri C. T. Water-Mediated Surface Diffusion Mechanism Enables the Cold Sintering Process: A Combined Computational and Experimental Study. Germany: N. p., 2019. Web. doi:10.1002/anie.201904738.
Sengul, Mert Y., Guo, Jing, Randall, Clive A., & van Duin, Adri C. T. Water-Mediated Surface Diffusion Mechanism Enables the Cold Sintering Process: A Combined Computational and Experimental Study. Germany. doi:10.1002/anie.201904738.
Sengul, Mert Y., Guo, Jing, Randall, Clive A., and van Duin, Adri C. T. Tue . "Water-Mediated Surface Diffusion Mechanism Enables the Cold Sintering Process: A Combined Computational and Experimental Study". Germany. doi:10.1002/anie.201904738.
@article{osti_1559059,
title = {Water-Mediated Surface Diffusion Mechanism Enables the Cold Sintering Process: A Combined Computational and Experimental Study},
author = {Sengul, Mert Y. and Guo, Jing and Randall, Clive A. and van Duin, Adri C. T.},
abstractNote = {},
doi = {10.1002/anie.201904738},
journal = {Angewandte Chemie (International Edition)},
number = 36,
volume = 58,
place = {Germany},
year = {2019},
month = {7}
}

Journal Article:
Free Publicly Available Full Text
This content will become publicly available on July 29, 2020
Publisher's Version of Record

Save / Share:

Works referenced in this record:

Cold Sintering: A Paradigm Shift for Processing and Integration of Ceramics
journal, August 2016

  • Guo, Jing; Guo, Hanzheng; Baker, Amanda L.
  • Angewandte Chemie International Edition, Vol. 55, Issue 38
  • DOI: 10.1002/anie.201605443

Hydrothermal Sintering for Densification of Silica. Evidence for the Role of Water
journal, April 2018


Hydroxylation Structure and Proton Transfer Reactivity at the Zinc Oxide−Water Interface
journal, April 2011

  • Raymand, David; van Duin, Adri C. T.; Goddard, William A.
  • The Journal of Physical Chemistry C, Vol. 115, Issue 17
  • DOI: 10.1021/jp106144p

Water-assisted flash sintering: Flashing ZnO at room temperature to achieve ~ 98% density in seconds
journal, January 2018


Densification during Sintering in the Presence of a Liquid Phase. I. Theory
journal, March 1959


Silver Tarnishing Mechanism Revealed by Molecular Dynamics Simulations
journal, March 2019

  • Saleh, Gabriele; Xu, Chen; Sanvito, Stefano
  • Angewandte Chemie, Vol. 131, Issue 18
  • DOI: 10.1002/ange.201901630

Cold Sintering: A Paradigm Shift for Processing and Integration of Ceramics
journal, August 2016

  • Guo, Jing; Guo, Hanzheng; Baker, Amanda L.
  • Angewandte Chemie, Vol. 128, Issue 38
  • DOI: 10.1002/ange.201605443

Enabling Computational Design of ZIFs Using ReaxFF
journal, September 2018

  • Yang, Yongjian; Shin, Yun Kyung; Li, Shichun
  • The Journal of Physical Chemistry B, Vol. 122, Issue 41
  • DOI: 10.1021/acs.jpcb.8b08094

Silver Tarnishing Mechanism Revealed by Molecular Dynamics Simulations
journal, March 2019

  • Saleh, Gabriele; Xu, Chen; Sanvito, Stefano
  • Angewandte Chemie International Edition, Vol. 58, Issue 18
  • DOI: 10.1002/anie.201901630

ReaxFF Molecular Dynamics Study on the Influence of Temperature on Adsorption, Desorption, and Decomposition at the Acetic Acid/Water/ZnO(101̅0) Interface Enabling Cold Sintering
journal, October 2018

  • Sengul, Mert Y.; Randall, Clive A.; van Duin, Adri C. T.
  • ACS Applied Materials & Interfaces, Vol. 10, Issue 43
  • DOI: 10.1021/acsami.8b13630

Geologically-inspired strong bulk ceramics made with water at room temperature
journal, March 2017

  • Bouville, Florian; Studart, André R.
  • Nature Communications, Vol. 8, Issue 1
  • DOI: 10.1038/ncomms14655

Cold Sintered Ceramic Nanocomposites of 2D MXene and Zinc Oxide
journal, June 2018

  • Guo, Jing; Legum, Benjamin; Anasori, Babak
  • Advanced Materials, Vol. 30, Issue 32
  • DOI: 10.1002/adma.201801846

A reactive force field (ReaxFF) for zinc oxide
journal, March 2008


ReaxFF:  A Reactive Force Field for Hydrocarbons
journal, October 2001

  • van Duin, Adri C. T.; Dasgupta, Siddharth; Lorant, Francois
  • The Journal of Physical Chemistry A, Vol. 105, Issue 41
  • DOI: 10.1021/jp004368u

Cold sintering of a Li-ion cathode: LiFePO4-composite with high volumetric capacity
journal, December 2017


Cold Sintering Na 2 Mo 2 O 7 Ceramic with Poly(ether imide) (PEI) Polymer to Realize High-Performance Composites and Integrated Multilayer Circuits
journal, July 2018

  • Guo, Jing; Pfeiffenberger, Neal; Beese, Allison
  • ACS Applied Nano Materials, Vol. 1, Issue 8
  • DOI: 10.1021/acsanm.8b00609

Water adsorption on stepped ZnO surfaces from MD simulation
journal, May 2010


Demonstration of the cold sintering process study for the densification and grain growth of ZnO ceramics
journal, October 2016

  • Funahashi, Shuichi; Guo, Jing; Guo, Hanzheng
  • Journal of the American Ceramic Society, Vol. 100, Issue 2
  • DOI: 10.1111/jace.14617

Accelerated ReaxFF Simulations for Describing the Reactive Cross-Linking of Polymers
journal, July 2018

  • Vashisth, Aniruddh; Ashraf, Chowdhury; Zhang, Weiwei
  • The Journal of Physical Chemistry A, Vol. 122, Issue 32
  • DOI: 10.1021/acs.jpca.8b03826