清洁Pt(111)上H和H2的物理吸附能作为量子蒙特卡罗计算中有用的表面能参考

{"title":"清洁Pt(111)上H和H2的物理吸附能作为量子蒙特卡罗计算中有用的表面能参考","authors":"Rajesh O. Sharma, P. Hoggan","doi":"10.1016/BS.AIQ.2019.04.007","DOIUrl":null,"url":null,"abstract":"","PeriodicalId":111159,"journal":{"name":"State of The Art of Molecular Electronic Structure Computations: Correlation Methods, Basis Sets and More","volume":"92 1","pages":"0"},"PeriodicalIF":0.0000,"publicationDate":"1900-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"5","resultStr":"{\"title\":\"Physisorption energy of H and H2 on clean Pt(111) as a useful surface energy reference in Quantum Monte Carlo calculation\",\"authors\":\"Rajesh O. Sharma, P. Hoggan\",\"doi\":\"10.1016/BS.AIQ.2019.04.007\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"\",\"PeriodicalId\":111159,\"journal\":{\"name\":\"State of The Art of Molecular Electronic Structure Computations: Correlation Methods, Basis Sets and More\",\"volume\":\"92 1\",\"pages\":\"0\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"1900-01-01\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"5\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"State of The Art of Molecular Electronic Structure Computations: Correlation Methods, Basis Sets and More\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://doi.org/10.1016/BS.AIQ.2019.04.007\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"State of The Art of Molecular Electronic Structure Computations: Correlation Methods, Basis Sets and More","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.1016/BS.AIQ.2019.04.007","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}