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Title: Low energy isomers of (H2O)25 from a hierarchical method based on Monte Carlo temperature basin paving and molecular tailoring approaches benchmarked by MP2 calculations

Authors:
 [1] ;  [1] ;  [2] ;  [2] ;  [3] ;  [3]
  1. Department of Chemistry, Indian Institute of Technology Kanpur, Kanpur 208016, India
  2. School of Computational and Integrative Sciences, Jawaharlal Nehru University, New Delhi 110067, India
  3. Physical Sciences Division, Pacific Northwest National Laboratory, 902 Battelle Boulevard, P.O. Box 999, MS K1-83, Richland, Washington 99352, USA
Publication Date:
OSTI Identifier:
1224236
Grant/Contract Number:
AC02-05CH11231
Type:
Publisher's Accepted Manuscript
Journal Name:
The Journal of Chemical Physics
Additional Journal Information:
Journal Volume: 141; Journal Issue: 16; Journal ID: ISSN 0021-9606
Publisher:
American Institute of Physics
Sponsoring Org:
USDOE
Country of Publication:
United States
Language:
English