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Title: Dynamics of recombination via conical intersection in a semiconductor nanocrystal

The ultrafast dynamics of nonradiative recombination at dangling bond defects is elucidated by nanoscale multireferenceab initiomolecular dynamics simulations.
Authors:
 [1] ; ORCiD logo [2] ; ORCiD logo [3] ; ORCiD logo [1]
  1. Michigan State Univ., East Lansing, MI (United States). Dept. of Chemistry
  2. Stanford Univ., CA (United States). Dept. of Chemistry; SLAC National Accelerator Lab., Menlo Park, CA (United States). Photon Ultrafast Laser Science and Engineering Inst. (PULSE)
  3. Univ. of Minnesota, Minneapolis, MN (United States). Dept. of Chemistry
Publication Date:
Grant/Contract Number:
CHE-1565634; AC02-76SF00515
Type:
Accepted Manuscript
Journal Name:
Chemical Science
Additional Journal Information:
Journal Volume: 9; Journal Issue: 3; Journal ID: ISSN 2041-6520
Publisher:
Royal Society of Chemistry
Research Org:
SLAC National Accelerator Lab., Menlo Park, CA (United States)
Sponsoring Org:
USDOE; National Science Foundation (NSF)
Country of Publication:
United States
Language:
English
Subject:
77 NANOSCIENCE AND NANOTECHNOLOGY; 37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY; Nanocrystal; Conical intersection
OSTI Identifier:
1419973
Alternate Identifier(s):
OSTI ID: 1475548

Peng, Wei-Tao, Fales, B. Scott, Shu, Yinan, and Levine, Benjamin G.. Dynamics of recombination via conical intersection in a semiconductor nanocrystal. United States: N. p., Web. doi:10.1039/c7sc04221c.
Peng, Wei-Tao, Fales, B. Scott, Shu, Yinan, & Levine, Benjamin G.. Dynamics of recombination via conical intersection in a semiconductor nanocrystal. United States. doi:10.1039/c7sc04221c.
Peng, Wei-Tao, Fales, B. Scott, Shu, Yinan, and Levine, Benjamin G.. 2018. "Dynamics of recombination via conical intersection in a semiconductor nanocrystal". United States. doi:10.1039/c7sc04221c. https://www.osti.gov/servlets/purl/1419973.
@article{osti_1419973,
title = {Dynamics of recombination via conical intersection in a semiconductor nanocrystal},
author = {Peng, Wei-Tao and Fales, B. Scott and Shu, Yinan and Levine, Benjamin G.},
abstractNote = {The ultrafast dynamics of nonradiative recombination at dangling bond defects is elucidated by nanoscale multireferenceab initiomolecular dynamics simulations.},
doi = {10.1039/c7sc04221c},
journal = {Chemical Science},
number = 3,
volume = 9,
place = {United States},
year = {2018},
month = {11}
}

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