{"title":"Lattice defects in quinacridone","authors":"D. Brey, Barbara Scherer, M. Schmidt","doi":"10.1107/s205252062200779x","DOIUrl":null,"url":null,"abstract":"Various lattice defects in the αI-phase of quinacridone (C20H12N2O2) were simulated using lattice-energy minimizations, including vacancies, stacking faults, screw and edge dislocations, twinning and orientational faults. Twinning and orientational faults of entire chains were calculated to occur most frequently.","PeriodicalId":7080,"journal":{"name":"Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials","volume":"9 1","pages":"763 - 780"},"PeriodicalIF":0.0000,"publicationDate":"2022-09-09","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.1107/s205252062200779x","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
引用次数: 0
Abstract
Various lattice defects in the αI-phase of quinacridone (C20H12N2O2) were simulated using lattice-energy minimizations, including vacancies, stacking faults, screw and edge dislocations, twinning and orientational faults. Twinning and orientational faults of entire chains were calculated to occur most frequently.