Zobrazeno 1 - 2
of 2
pro vyhledávání: '"Theorical Chemistry"'
Autor:
Coquil, Mathilde
Publikováno v:
Autre. Université Montpellier, 2021. Français. ⟨NNT : 2021MONTS136⟩
Despite its importance, the description of liquid-liquid extraction is made difficult because the link between experimental methods and molecular dynamics simulations is not direct due to the existence of organization phenomena. We propose a new meth
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=od______3515::7d28e849025604bd8d82353328524898
https://theses.hal.science/tel-03772856/file/COQUIL_2021_archivage.pdf
https://theses.hal.science/tel-03772856/file/COQUIL_2021_archivage.pdf
Publikováno v:
Digital.CSIC. Repositorio Institucional del CSIC
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10 pages, 8 figures.-- PMID: 17290977 [PubMed].
Supporting information (cartesian coordinates of the CASSCF/6-311+G(3d,2p)-optimized geometries, tables S1-S2, figures S1-S4, 9 pages) available at: http://pubs.acs.org/doi/suppl/10.1021/jp066823d/
Supporting information (cartesian coordinates of the CASSCF/6-311+G(3d,2p)-optimized geometries, tables S1-S2, figures S1-S4, 9 pages) available at: http://pubs.acs.org/doi/suppl/10.1021/jp066823d/
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::3f459687382c4205c787c223925533f5
http://hdl.handle.net/10261/9329
http://hdl.handle.net/10261/9329