Accurate description of nuclear quantum effects with high-order perturbed path integrals (HOPPI)

Reference : Accurate description of nuclear quantum effects with high-order perturbed path integr...


	Document type :	Scientific journals : Article
	Discipline(s) :	Physical, chemical, mathematical & earth Sciences : Physics
	Focus Areas :	Physics and Materials Science
	To cite this reference:	http://hdl.handle.net/10993/45764

Title :	Accurate description of nuclear quantum effects with high-order perturbed path integrals (HOPPI)
Language :	English
Author, co-author :	Poltavskyi, Igor [University of Luxembourg > Faculty of Science, Technology and Medicine (FSTM) > Department of Physics and Materials Science (DPHYMS) >]
	Kapil, Venkat []
	Ceriotti, Michele []
	Kim, Kwang S []
	Tkatchenko, Alexandre [University of Luxembourg > Faculty of Science, Technology and Medicine (FSTM) > Department of Physics and Materials Science (DPHYMS) >]
Publication date :	2020
Journal title :	Journal of Chemical Theory and Computation
Publisher :	American Chemical Society
Peer reviewed :	Yes
ISSN :	1549-9618
e-ISSN :	1549-9626
Country :	DC
Permalink :	http://hdl.handle.net/10993/45764

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	File	Commentary	Version	Size	Access
Open access	155-HOPPI-JCTC-2020.pdf		Publisher postprint	2.21 MB	View/Open

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