DC Field | Value | Language |
---|---|---|
dc.contributor.author | Ryu, Dayoung | ko |
dc.contributor.author | Kim, Jihan | ko |
dc.date.accessioned | 2023-07-04T02:02:07Z | - |
dc.date.available | 2023-07-04T02:02:07Z | - |
dc.date.created | 2023-07-03 | - |
dc.date.created | 2023-07-03 | - |
dc.date.issued | 2023-05 | - |
dc.identifier.citation | JOURNAL OF PHYSICAL CHEMISTRY C, v.127, no.21, pp.10384 - 10390 | - |
dc.identifier.issn | 1932-7447 | - |
dc.identifier.uri | http://hdl.handle.net/10203/310241 | - |
dc.description.abstract | Most metal-organic frameworks are composed ofa single organiclinker bridging between two different metal clusters. On the otherhand, "double-linker" MOFs, which can be formed by bridgingtwo different metal clusters with two organic ligands, are comparativelyrare. In this work, we devise an algorithm that can computationallygenerate these double-linker MOFs and use our strategy to build alarge database of hypothetical double-linker MOFs. These MOFs tendto have large pore volumes compared to other experimentally synthesizedMOFs and can serve to expand the set of potential MOFs for variousenergy and environmental-related applications. | - |
dc.language | English | - |
dc.publisher | AMER CHEMICAL SOC | - |
dc.title | Database Design for Double-Linker Metal-Organic Frameworks | - |
dc.type | Article | - |
dc.identifier.wosid | 001011820200001 | - |
dc.identifier.scopusid | 2-s2.0-85162762662 | - |
dc.type.rims | ART | - |
dc.citation.volume | 127 | - |
dc.citation.issue | 21 | - |
dc.citation.beginningpage | 10384 | - |
dc.citation.endingpage | 10390 | - |
dc.citation.publicationname | JOURNAL OF PHYSICAL CHEMISTRY C | - |
dc.identifier.doi | 10.1021/acs.jpcc.3c02142 | - |
dc.contributor.localauthor | Kim, Jihan | - |
dc.contributor.nonIdAuthor | Ryu, Dayoung | - |
dc.description.isOpenAccess | N | - |
dc.type.journalArticle | Article | - |
dc.subject.keywordPlus | HYDROGEN STORAGE | - |
dc.subject.keywordPlus | CHEMISTRY | - |
dc.subject.keywordPlus | MOFS | - |
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