{"title":"第九章-从第一性原理模拟氧化物表面的结构和反应性","authors":"S. Bates, S. Elliott","doi":"10.1016/S1380-7323(04)80023-2","DOIUrl":null,"url":null,"abstract":"","PeriodicalId":17388,"journal":{"name":"Journal of Theoretical and Computational Chemistry","volume":"5 1","pages":"297-324"},"PeriodicalIF":0.0000,"publicationDate":"2004-12-31","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"1","resultStr":"{\"title\":\"Chapter 9 – Simulating the structure and reactivity of oxide surfaces from first principles\",\"authors\":\"S. Bates, S. Elliott\",\"doi\":\"10.1016/S1380-7323(04)80023-2\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"\",\"PeriodicalId\":17388,\"journal\":{\"name\":\"Journal of Theoretical and Computational Chemistry\",\"volume\":\"5 1\",\"pages\":\"297-324\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2004-12-31\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"1\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Journal of Theoretical and Computational Chemistry\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://doi.org/10.1016/S1380-7323(04)80023-2\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Theoretical and Computational Chemistry","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.1016/S1380-7323(04)80023-2","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}