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Although the prevailing mechanistic model indicates that light emits from charge separation and recombination in fracture planes arising from polar structures, its application in designing triboluminescent materials remains limited owing to numerous exceptions. This study provides insights into the essential requirements for triboluminescence by investigating the structural and electrostatic properties of fractured crystals of copper thiocyanate complexes. The examined fracture plane indicated that charge pairs (which are essential for light emission) form when intermolecular interactions are disrupted during fracturing. On the basis of the nature of these charges, we successfully suppressed triboluminescence by inhibiting the formation of intermolecular interactions disrupted in the examined complexes. Furthermore, we induced its re\u2010emergence by creating an alternative fracture plane through controlled manipulation of the molecular network. This demonstrative deactivation and reactivation of triboluminescence underscores the critical role of intermolecular disruption in generating charge pairs, a prerequisite for triboluminescence.<\/jats:p>","DOI":"10.1002\/chem.202401715","type":"journal-article","created":{"date-parts":[[2024,7,9]],"date-time":"2024-07-09T06:02:28Z","timestamp":1720504948000},"update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":4,"title":["Investigating the Mechanism of Triboluminescence: Insights from Structural and Electrostatic Characterization of Copper Thiocyanate Complexes"],"prefix":"10.1002","volume":"30","author":[{"ORCID":"https:\/\/orcid.org\/0000-0002-5531-0706","authenticated-orcid":false,"given":"Manabu","family":"Hoshino","sequence":"first","affiliation":[{"name":"Graduate School of Medicine, and General Medical Education and Research Center Teikyo University  2-11-1, Kaga, Itabashi-ku Tokyo 173-8605 Japan"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Yoshiki","family":"Ohgo","sequence":"additional","affiliation":[{"name":"Graduate School of Medicine, and General Medical Education and Research Center Teikyo University  2-11-1, Kaga, Itabashi-ku Tokyo 173-8605 Japan"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"311","published-online":{"date-parts":[[2024,9,3]]},"reference":[{"key":"e_1_2_7_1_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.chempr.2018.01.001"},{"key":"e_1_2_7_2_1","doi-asserted-by":"publisher","DOI":"10.1002\/anie.201409767"},{"key":"e_1_2_7_3_1","doi-asserted-by":"publisher","DOI":"10.1002\/adma.201606914"},{"key":"e_1_2_7_4_1","doi-asserted-by":"publisher","DOI":"10.1021\/j150653a007"},{"key":"e_1_2_7_5_1","doi-asserted-by":"publisher","DOI":"10.1021\/j100544a007"},{"key":"e_1_2_7_6_1","doi-asserted-by":"publisher","DOI":"10.1088\/0022-3727\/40\/5\/023"},{"key":"e_1_2_7_7_1","doi-asserted-by":"publisher","DOI":"10.1063\/1.331773"},{"key":"e_1_2_7_8_1","doi-asserted-by":"publisher","DOI":"10.1038\/nature07378"},{"key":"e_1_2_7_9_1","doi-asserted-by":"publisher","DOI":"10.1021\/jacs.2c06724"},{"key":"e_1_2_7_10_1","doi-asserted-by":"publisher","DOI":"10.1038\/s41427-022-00374-8"},{"key":"e_1_2_7_11_1","doi-asserted-by":"publisher","DOI":"10.1111\/jace.16444"},{"key":"e_1_2_7_12_1","doi-asserted-by":"publisher","DOI":"10.1002\/adma.201405826"},{"key":"e_1_2_7_13_1","doi-asserted-by":"publisher","DOI":"10.1039\/C4EE01776E"},{"key":"e_1_2_7_14_1","doi-asserted-by":"publisher","DOI":"10.1039\/b007029g"},{"key":"e_1_2_7_15_1","doi-asserted-by":"publisher","DOI":"10.1063\/1.125695"},{"key":"e_1_2_7_16_1","doi-asserted-by":"publisher","DOI":"10.1063\/1.123510"},{"key":"e_1_2_7_17_1","doi-asserted-by":"publisher","DOI":"10.1080\/00018737700101483"},{"key":"e_1_2_7_18_1","doi-asserted-by":"publisher","DOI":"10.1021\/ic50212a054"},{"key":"e_1_2_7_19_1","doi-asserted-by":"publisher","DOI":"10.1039\/D3CC01525D"},{"key":"e_1_2_7_20_1","doi-asserted-by":"publisher","DOI":"10.1039\/D1DT04305F"},{"key":"e_1_2_7_21_1","doi-asserted-by":"publisher","DOI":"10.1021\/acs.inorgchem.7b00273"},{"key":"e_1_2_7_22_1","doi-asserted-by":"publisher","DOI":"10.1039\/D2CS00481J"},{"key":"e_1_2_7_23_1","doi-asserted-by":"publisher","DOI":"10.1039\/D3NJ02174B"},{"key":"e_1_2_7_24_1","doi-asserted-by":"publisher","DOI":"10.1021\/acs.molpharmaceut.1c00978"},{"key":"e_1_2_7_25_1","doi-asserted-by":"publisher","DOI":"10.1021\/acs.cgd.8b00202"},{"key":"e_1_2_7_26_1","doi-asserted-by":"publisher","DOI":"10.1021\/ed2001494"},{"key":"e_1_2_7_27_1","unstructured":"Deposition Number(s)https:\/\/www.ccdc.cam.ac.uk\/services\/structures?id=doi:10.1002\/chem.2024017152343653 (for [Cu(NCS)(py)2(PPh3)]) 2343654 (for [Cu(NCS)(PPh3)2]2) 2343655 (for [Cu(NCS)(2Etpy)(PPh3)]2) 2343656 (for [Cu(NCS)(3Mepy)2(PPh3)]) 2343657 (for [Cu(NCS)(2Mepy)(PPh3)]2) and 2343658 (for [Cu(NCS)(4Mepy)2(PPh3)]\u22c54Mepy) contain(s) the supplementary crystallographic data for this paper. These data are provided free of charge by the joint Cambridge Crystallographic Data Centre and Fachinformationszentrum Karlsruhehttp:\/\/www.ccdc.cam.ac.uk\/structuresAccess Structures service."},{"key":"e_1_2_7_28_1","doi-asserted-by":"crossref","unstructured":"C. Pettinari C. Di\u2005Nicola F. Marchetti R. Pettinari B.\u2005W. Skelton N. Somers A.\u2005H. White W.\u2005T. Robinson M.\u2005R. Chierotti R. Gobetto C. Nervi Eur. J. Inorg. 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