Using Gaussian process regression to simulate the vibrational Raman spectra of molecular crystals
Nathaniel Raimbault3,1, Andrea Grisafi3,2, Michele Ceriotti2 and Mariana Rossi4,1
Published 1 October 2019 •
© 2019 The Author(s). Published by IOP Publishing Ltd on behalf of the Institute of Physics and Deutsche Physikalische Gesellschaft
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Citation Nathaniel Raimbault et al 2019 New J. Phys. 21 105001
DOI 10.1088/1367-2630/ab4509
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