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  4. An Adapted Similarity Kernel and Generalized Convex Hull for Molecular Crystal Structure Prediction
 
research article

An Adapted Similarity Kernel and Generalized Convex Hull for Molecular Crystal Structure Prediction

Martin, Jennie
•
Ceriotti, Michele  
•
Day, Graeme M.
October 23, 2025
Crystal Growth & Design
  • Details
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Type
research article
DOI
10.1021/acs.cgd.5c01220
Author(s)
Martin, Jennie

University of Southampton

Ceriotti, Michele  

École Polytechnique Fédérale de Lausanne

Day, Graeme M.

University of Southampton

Date Issued

2025-10-23

Publisher

American Chemical Society (ACS)

Published in
Crystal Growth & Design
Article Number

acs.cgd.5c01220

Editorial or Peer reviewed

REVIEWED

Written at

EPFL

EPFL units
COSMO  
FunderFunding(s)Grant NumberGrant URL

UK Research and Innovation

EP/X035859

Leverhulme Research Centre for Functional Materials Design

Available on Infoscience
October 28, 2025
Use this identifier to reference this record
https://infoscience.epfl.ch/handle/20.500.14299/255287
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