{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,3,12]],"date-time":"2026-03-12T06:33:17Z","timestamp":1773297197474,"version":"3.50.1"},"reference-count":53,"publisher":"MDPI AG","issue":"5","license":[{"start":{"date-parts":[[2019,5,8]],"date-time":"2019-05-08T00:00:00Z","timestamp":1557273600000},"content-version":"vor","delay-in-days":0,"URL":"https:\/\/creativecommons.org\/licenses\/by\/4.0\/"}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["Nanomaterials"],"abstract":"<jats:p>Although dibenzyl disulfide (DBDS) is used as a mineral oil stabilizer, its presence in electrical transformer oil is associated as one of the major causes of copper corrosion and subsequent formation of copper sulfide. In order to prevent these undesirable processes, MY zeolites (with M = Li, Na, K, Cs, Cu or Ag) are proposed to adsorb molecularly DBDS. In this study, different MY zeolites are investigated at the DFT+D level in order to assess their ability in DBDS adsorption. It was found that CsY, AgY and CuY exhibit the best compromise between high interaction energies and limited S-S bond activation, thus emerging as optimal adsorbents for DBDS.<\/jats:p>","DOI":"10.3390\/nano9050715","type":"journal-article","created":{"date-parts":[[2019,5,13]],"date-time":"2019-05-13T03:57:07Z","timestamp":1557719827000},"page":"715","update-policy":"https:\/\/doi.org\/10.3390\/mdpi_crossmark_policy","source":"Crossref","is-referenced-by-count":18,"title":["Dibenzyl Disulfide Adsorption on Cationic Exchanged Faujasites: A DFT Study"],"prefix":"10.3390","volume":"9","author":[{"given":"Etienne Paul","family":"Hessou","sequence":"first","affiliation":[{"name":"Laboratoire de Physique et Chimie Th\u00e9oriques, Facult\u00e9 des Sciences et Technologies, CNRS, Universit\u00e9 de Lorraine, Boulevard des Aiguillettes, 54500 Vandoeuvre-l\u00e8s-Nancy, France"},{"name":"Laboratoire de Chimie Th\u00e9orique et de Spectroscopie Mol\u00e9culaire, Universit\u00e9 d\u2019Abomey-Calavi, 03 BP 3409 Cotonou, Benin"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-6028-3167","authenticated-orcid":false,"given":"Miguel","family":"Ponce-Vargas","sequence":"additional","affiliation":[{"name":"Institut de Chimie Mol\u00e9culaire de Reims, Universit\u00e9 de Reims Champagne-Ardenne, 51687 Reims, France"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Jean-Baptiste","family":"Mensah","sequence":"additional","affiliation":[{"name":"Laboratoire de Chimie Th\u00e9orique et de Spectroscopie Mol\u00e9culaire, Universit\u00e9 d\u2019Abomey-Calavi, 03 BP 3409 Cotonou, Benin"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-6760-6176","authenticated-orcid":false,"given":"Frederik","family":"Tielens","sequence":"additional","affiliation":[{"name":"Chemistry (ALGC), Vrije Universiteit Brussel, Pleinlaan 2, B-1050 Brussel, Belgium"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Juan Carlos","family":"Santos","sequence":"additional","affiliation":[{"name":"Laboratorio de Corrosi\u00f3n, Departamento de Ciencias Qu\u00edmicas, Facultad de Ciencias Exactas, Universidad Andres Bello, Av. Rep\u00fablica 330, 8370186 Santiago, Chile"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-3504-4180","authenticated-orcid":false,"given":"Michael","family":"Badawi","sequence":"additional","affiliation":[{"name":"Laboratoire de Physique et Chimie Th\u00e9oriques, Facult\u00e9 des Sciences et Technologies, CNRS, Universit\u00e9 de Lorraine, Boulevard des Aiguillettes, 54500 Vandoeuvre-l\u00e8s-Nancy, France"}],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"1968","published-online":{"date-parts":[[2019,5,8]]},"reference":[{"key":"ref_1","doi-asserted-by":"crossref","first-page":"3321","DOI":"10.1109\/TDEI.2015.005309","article-title":"Removal of corrosive sulfur from insulating oil with adsorption method","volume":"22","author":"Wan","year":"2015","journal-title":"IEEE Trans. Dielectr. Electr. 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