Please use this identifier to cite or link to this item: http://hdl.handle.net/1942/39003
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dc.contributor.authorMitryukovskiy, Sergey-
dc.contributor.authorVANPOUCKE, Danny E.P.-
dc.contributor.authorHannotte, Theo-
dc.contributor.authorLavancier, Melanie-
dc.contributor.authorHourlier, Djamila-
dc.contributor.authorRoos, Goedele-
dc.contributor.authorPeretti, Romain-
dc.date.accessioned2022-12-06T08:09:07Z-
dc.date.available2022-12-06T08:09:07Z-
dc.date.issued2022-
dc.date.submitted2022-12-01T12:06:36Z-
dc.identifier.citation2022 47TH INTERNATIONAL CONFERENCE ON INFRARED, MILLIMETER AND TERAHERTZ WAVES (IRMMW-THZ 2022), IEEE,-
dc.identifier.isbn978-1-7281-9427-1-
dc.identifier.issn2162-2027-
dc.identifier.urihttp://hdl.handle.net/1942/39003-
dc.description.abstractThe collective vibrations in molecular crystals can be probed using terahertz spectroscopy, providing unique characteristic spectral fingerprints. However, the association of the spectral features to the crystal conformation, crystal phase and its environment is a difficult task. We present a combined computational-experimental study on the incorporation of water in lactose molecular crystals, and show how simulations can be used to associate spectral features in the THz region to crystal conformations and phases. Furthermore, we also show that water does not play only a perturbative role but fully participates in the emergence of the THz vibrations-
dc.language.isoen-
dc.publisherIEEE-
dc.relation.ispartofseriesInternational Conference on Infrared Millimeter and Terahertz Waves-
dc.rights2022 IEEE-
dc.subject.otherMolecular Conformation-
dc.subject.otherWater-
dc.subject.otherTerahertz Spectroscopy-
dc.subject.otherVibration-
dc.titleOn the influence of water on THz vibrational spectral features of molecular crystals-
dc.typeProceedings Paper-
local.bibliographicCitation.conferencedateAUG 28-SEP 02, 2022-
local.bibliographicCitation.conferencename47th International Conference on Infrared, Millimeter and Terahertz Waves (IRMMW-THz)-
local.bibliographicCitation.conferenceplaceDelft, NETHERLANDS-
dc.identifier.issue10-
dc.identifier.volume24-
local.bibliographicCitation.jcatC1-
dc.description.notesPeretti, R (corresponding author), Univ Lille, CNRS, Inst Elect Microelect & Nanotechnol, F-59652 Villeneuve Dascq, France.-
dc.description.notesromain.peretti@univ-lille.fr-
local.publisher.place345 E 47TH ST, NEW YORK, NY 10017 USA-
local.type.refereedRefereed-
local.type.specifiedProceedings Paper-
dc.identifier.doi10.1109/IRMMW-THz50927.2022.9896035-
dc.identifier.pmid35212691-
dc.identifier.isi000865953000517-
dc.contributor.orcidPERETTI, Romain/0000-0002-1707-7341; Vanpoucke, Danny E-
dc.contributor.orcidP/0000-0001-5919-7336-
dc.identifier.eissn1463-9084-
local.provider.typewosris-
local.bibliographicCitation.btitle2022 47TH INTERNATIONAL CONFERENCE ON INFRARED, MILLIMETER AND TERAHERTZ WAVES (IRMMW-THZ 2022)-
local.description.affiliation[Mitryukovskiy, Sergey; Hannotte, Theo; Lavancier, Melanie; Hourlier, Djamila; Peretti, Romain] Univ Lille, CNRS, Inst Elect Microelect & Nanotechnol, F-59652 Villeneuve Dascq, France.-
local.description.affiliation[Vanpoucke, Danny E. P.] Hasselt Univ, IMO, B-3590 Diepenbeek, Belgium.-
local.description.affiliation[Roos, Goedele] Univ Lille, UGSF Unite Glycobiol Struct & Fonct, CNRS, UMR 8576, F-59000 Lille, France.-
local.uhasselt.internationalyes-
item.fulltextWith Fulltext-
item.accessRightsOpen Access-
item.fullcitationMitryukovskiy, Sergey; VANPOUCKE, Danny E.P.; Hannotte, Theo; Lavancier, Melanie; Hourlier, Djamila; Roos, Goedele & Peretti, Romain (2022) On the influence of water on THz vibrational spectral features of molecular crystals. In: 2022 47TH INTERNATIONAL CONFERENCE ON INFRARED, MILLIMETER AND TERAHERTZ WAVES (IRMMW-THZ 2022), IEEE,.-
item.validationecoom 2023-
item.contributorMitryukovskiy, Sergey-
item.contributorVANPOUCKE, Danny E.P.-
item.contributorHannotte, Theo-
item.contributorLavancier, Melanie-
item.contributorHourlier, Djamila-
item.contributorRoos, Goedele-
item.contributorPeretti, Romain-
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