{"created":"2025-02-21T04:14:26.595988+00:00","id":2008147,"links":{},"metadata":{"_buckets":{"deposit":"379b6e28-5ee7-4b74-ab2a-30ce39ed2389"},"_deposit":{"created_by":41,"id":"2008147","owners":[41],"pid":{"revision_id":0,"type":"depid","value":"2008147"},"status":"published"},"_oai":{"id":"oai:hiroshima.repo.nii.ac.jp:02008147","sets":["1730444907710"]},"author_link":[],"item_1617186331708":{"attribute_name":"Title","attribute_value_mlt":[{"subitem_title":"First-principles molecular-dynamics simulation of liquid rubidium under high pressures","subitem_title_language":"en"}]},"item_1617186419668":{"attribute_name":"Creator","attribute_type":"creator","attribute_value_mlt":[{"creatorNames":[{"creatorName":"Shimojo, Fuyuki","creatorNameLang":"en"}],"familyNames":[{"familyName":"Shimojo","familyNameLang":"en"}],"givenNames":[{"givenName":"Fuyuki","givenNameLang":"en"}]},{"creatorNames":[{"creatorName":"Zempo, Yasunari","creatorNameLang":"en"}],"familyNames":[{"familyName":"Zempo","familyNameLang":"en"}],"givenNames":[{"givenName":"Yasunari","givenNameLang":"en"}]},{"creatorNames":[{"creatorName":"Hoshino, Kozo","creatorNameLang":"en"}],"familyNames":[{"familyName":"Hoshino","familyNameLang":"en"}],"givenNames":[{"givenName":"Kozo","givenNameLang":"en"}]},{"creatorNames":[{"creatorName":"Watabe, Mitsuo","creatorNameLang":"en"}],"familyNames":[{"familyName":"Watabe","familyNameLang":"en"}],"givenNames":[{"givenName":"Mitsuo","givenNameLang":"en"}]}]},"item_1617186476635":{"attribute_name":"Access Rights","attribute_value_mlt":[{"subitem_access_right":"open access","subitem_access_right_uri":"http://purl.org/coar/access_right/c_abf2"}]},"item_1617186499011":{"attribute_name":"Rights","attribute_value_mlt":[{"subitem_rights":"Copyright (c) 1997 American Physical Society."}]},"item_1617186626617":{"attribute_name":"Description","attribute_value_mlt":[{"subitem_description":"The effects of compression on the structural and electronic properties of liquid rubidium are studied along the melting curve by means of a first-principles molecular-dynamics simulation. It is shown that the calculated pair distribution functions g(r) are in good agreement with the experimental results for a wide range of pressures; the liquid rubidium is compressed uniformly at 2.5 GPa, and there exist some deviations from the uniform compression at 6.1 GPa. This structural change to a denser state is related to an electronic s-d transition in the liquid state. It is found that, near the triple point, the electronic density of states consists mostly of the s component and, with increasing pressure, the s component decreases gradually over a wide range of energy, and the d component near the Fermi level increases.","subitem_description_language":"en"}]},"item_1617186643794":{"attribute_name":"Publisher","attribute_value_mlt":[{"subitem_publisher":"American Physical Society"}]},"item_1617186702042":{"attribute_name":"Language","attribute_value_mlt":[{"subitem_language":"eng"}]},"item_1617186920753":{"attribute_name":"Source Identifier","attribute_value_mlt":[{"subitem_source_identifier":"1098-0121","subitem_source_identifier_type":"ISSN"},{"subitem_source_identifier":"AA11187113","subitem_source_identifier_type":"NCID"}]},"item_1617187024783":{"attribute_name":"Page Start","attribute_value_mlt":[{"subitem_start_page":"5708"}]},"item_1617187056579":{"attribute_name":"Bibliographic Information","attribute_value_mlt":[{"bibliographicIssueDates":{"bibliographicIssueDate":"1997-05-01","bibliographicIssueDateType":"Issued"},"bibliographicIssueNumber":"9","bibliographicPageEnd":"5711","bibliographicPageStart":"5708","bibliographicVolumeNumber":"55","bibliographic_titles":[{"bibliographic_title":"Physical Review B - Condensed Matter and Materials Physics"},{"bibliographic_title":"Physical Review B - Condensed Matter and Materials Physics"}]}]},"item_1617258105262":{"attribute_name":"Resource Type","attribute_value_mlt":[{"resourcetype":"journal article","resourceuri":"http://purl.org/coar/resource_type/c_6501"}]},"item_1617265215918":{"attribute_name":"Version Type","attribute_value_mlt":[{"subitem_version_resource":"http://purl.org/coar/version/c_970fb48d4fbd8a85","subitem_version_type":"VoR"}]},"item_1617353299429":{"attribute_name":"Relation","attribute_value_mlt":[{"subitem_relation_type_id":{"subitem_relation_type_id_text":"10.1103/PhysRevB.55.5708","subitem_relation_type_select":"DOI"}},{"subitem_relation_type_id":{"subitem_relation_type_id_text":"http://dx.doi.org/10.1103/PhysRevB.55.5708","subitem_relation_type_select":"DOI"}}]},"item_1617605131499":{"attribute_name":"File","attribute_type":"file","attribute_value_mlt":[{"accessrole":"open_access","date":[{"dateType":"Available","dateValue":"2023-03-18"}],"displaytype":"simple","filename":"PhysRevB_55_5708.pdf","filesize":[{"value":"73.6 KB"}],"mimetype":"application/pdf","url":{"objectType":"fulltext","url":"https://hiroshima.repo.nii.ac.jp/record/2008147/files/PhysRevB_55_5708.pdf"},"version_id":"bfb7dd74-ecf9-4cd5-9c01-b6151eb7c856"}]},"item_1732771732025":{"attribute_name":"旧ID","attribute_value":"18644"},"item_title":"First-principles molecular-dynamics simulation of liquid rubidium under high pressures","item_type_id":"40003","owner":"41","path":["1730444907710"],"pubdate":{"attribute_name":"PubDate","attribute_value":"2023-03-18"},"publish_date":"2023-03-18","publish_status":"0","recid":"2008147","relation_version_is_last":true,"title":["First-principles molecular-dynamics simulation of liquid rubidium under high pressures"],"weko_creator_id":"41","weko_shared_id":-1},"updated":"2025-02-22T03:15:34.267058+00:00"}