skip to main content

DOE PAGESDOE PAGES

Title: Rotation mechanism of methylammonium molecules in organometal halide perovskite in cubic phase: An ab initio molecular dynamics study

Authors:
ORCiD logo [1] ;  [2] ;  [2] ;  [3] ;  [3] ;  [3]
  1. Graduate School of System Informatics, Kobe University, Kobe 657-8501, Japan
  2. Department of Physics, Kumamoto University, Kumamoto 860-8555, Japan
  3. Collaboratory for Advanced Computing and Simulations, Department of Physics and Astronomy, Department of Computer Science, and Department of Chemical Engineering and Materials Science, University of Southern California, Los Angeles, California 90089-0242, USA
Publication Date:
Grant/Contract Number:
# DE-FG02-04ER-46130
Type:
Publisher's Accepted Manuscript
Journal Name:
Journal of Chemical Physics
Additional Journal Information:
Journal Volume: 145; Journal Issue: 22; Related Information: CHORUS Timestamp: 2018-02-15 01:07:54; Journal ID: ISSN 0021-9606
Publisher:
American Institute of Physics
Sponsoring Org:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Country of Publication:
United States
Language:
English
OSTI Identifier:
1421232