{"_buckets": {"deposit": "74f204ef-4d86-48fe-93a8-a5712f77f5b1"}, "_deposit": {"id": "2015", "owners": [], "pid": {"revision_id": 0, "type": "depid", "value": "2015"}, "status": "published"}, "_oai": {"id": "oai:niigata-u.repo.nii.ac.jp:00002015"}, "item_5_biblio_info_6": {"attribute_name": "\u66f8\u8a8c\u60c5\u5831", "attribute_value_mlt": [{"bibliographicIssueDates": {"bibliographicIssueDate": "2005", "bibliographicIssueDateType": "Issued"}, "bibliographicIssueNumber": "144307", "bibliographicPageEnd": "144307-10", "bibliographicPageStart": "144307-1", "bibliographicVolumeNumber": "122", "bibliographic_titles": [{"bibliographic_title": "Journal of Chemical Physics"}, {"bibliographic_title": "Journal of Chemical Physics", "bibliographic_titleLang": "en"}]}]}, "item_5_description_4": {"attribute_name": "\u6284\u9332", "attribute_value_mlt": [{"subitem_description": "Transition probabilities were evaluated for the X 1A1-\u00c3 1B1 and \u00c3 1B1-B 1A1 systems of SiH2 and SiD2 to analyze the X\u2192\u00c3\u2192B photoexcitation. The Franck\u2013Condon factors (FCFs) and Einstein\u0027s B coefficients were computed by quantum vibrational calculations using the three-dimensional potential energy surfaces (PESs) of the SiH2(X1A1,\u00c31B1,B1A1) electronic states and the electronic transition moments for the X-\u00c3, X-B, and \u00c3-B system. The global PESs were determined by the multireference configuration interaction calculations with the Davidson correction and the interpolant moving least-squares method combined with the Shepard interpolation. The obtained FCFs for the X-\u00c3 and \u00c3-B systems exhibit that the bending mode is strongly enhanced in the excitation since the equilibrium bond angle greatly varies with the three states; the barrier to linearity is evaluated to be 21 900 cm\u20131 for the X state, 6400 cm\u20131 for the \u00c3 state, and 230\u2013240 cm\u20131 for the B state. The theoretical lifetimes for the pure bending levels of the \u00c3 and B states were calculated from the fluorescence decay rates for the \u00c3-X, B-\u00c3, and B-X emissions.", "subitem_description_type": "Abstract"}]}, "item_5_full_name_3": {"attribute_name": "\u8457\u8005\u5225\u540d", "attribute_value_mlt": [{"nameIdentifiers": [{"nameIdentifier": "6644", "nameIdentifierScheme": "WEKO"}], "names": [{"name": "\u5fb3\u6c5f, \u90c1\u96c4"}]}]}, "item_5_publisher_7": {"attribute_name": "\u51fa\u7248\u8005", "attribute_value_mlt": [{"subitem_publisher": "American Institute of Physics"}]}, "item_5_relation_14": {"attribute_name": "DOI", "attribute_value_mlt": [{"subitem_relation_type_id": {"subitem_relation_type_id_text": "info:doi/10.1063/1.1876112", "subitem_relation_type_select": "DOI"}}]}, "item_5_rights_15": {"attribute_name": "\u6a29\u5229", "attribute_value_mlt": [{"subitem_rights": "\u00a92005 American Institute of Physics"}]}, "item_5_select_19": {"attribute_name": "\u8457\u8005\u7248\u30d5\u30e9\u30b0", "attribute_value_mlt": [{"subitem_select_item": "publisher"}]}, "item_5_source_id_11": {"attribute_name": "\u66f8\u8a8c\u30ec\u30b3\u30fc\u30c9ID", "attribute_value_mlt": [{"subitem_source_identifier": "AA00694991", "subitem_source_identifier_type": "NCID"}]}, "item_5_source_id_9": {"attribute_name": "ISSN", "attribute_value_mlt": [{"subitem_source_identifier": "00219606", "subitem_source_identifier_type": "ISSN"}]}, "item_creator": {"attribute_name": "\u8457\u8005", "attribute_type": "creator", "attribute_value_mlt": [{"creatorNames": [{"creatorName": "Tokue, Ikuo"}], "nameIdentifiers": [{"nameIdentifier": "6641", "nameIdentifierScheme": "WEKO"}]}, {"creatorNames": [{"creatorName": "Yamasaki, Katsuyoshi"}], "nameIdentifiers": [{"nameIdentifier": "6642", "nameIdentifierScheme": "WEKO"}]}, {"creatorNames": [{"creatorName": "Nanbu, Shinkoh"}], "nameIdentifiers": [{"nameIdentifier": "6643", "nameIdentifierScheme": "WEKO"}]}]}, "item_files": {"attribute_name": "\u30d5\u30a1\u30a4\u30eb\u60c5\u5831", "attribute_type": "file", "attribute_value_mlt": [{"accessrole": "open_date", "date": [{"dateType": "Available", "dateValue": "2019-07-29"}], "displaytype": "detail", "download_preview_message": "", "file_order": 0, "filename": "13_0006.pdf", "filesize": [{"value": "1.2 MB"}], "format": "application/pdf", "future_date_message": "", "is_thumbnail": false, "licensetype": "license_free", "mimetype": "application/pdf", "size": 1200000.0, "url": {"label": "13_0006.pdf", "url": "https://niigata-u.repo.nii.ac.jp/record/2015/files/13_0006.pdf"}, "version_id": "7b6261a3-0127-4753-ac82-7a9ac12d7420"}]}, "item_language": {"attribute_name": "\u8a00\u8a9e", "attribute_value_mlt": [{"subitem_language": "eng"}]}, "item_resource_type": {"attribute_name": "\u8cc7\u6e90\u30bf\u30a4\u30d7", "attribute_value_mlt": [{"resourcetype": "journal article", "resourceuri": "http://purl.org/coar/resource_type/c_6501"}]}, "item_title": "Vibrational energies for the X 1A1, \u00c3 1B1, and B 1A1 states of SiH2/SiD2 and related transition probabilities based on global potential energy surfaces", "item_titles": {"attribute_name": "\u30bf\u30a4\u30c8\u30eb", "attribute_value_mlt": [{"subitem_title": "Vibrational energies for the X 1A1, \u00c3 1B1, and B 1A1 states of SiH2/SiD2 and related transition probabilities based on global potential energy surfaces"}, {"subitem_title": "Vibrational energies for the X 1A1, \u00c3 1B1, and B 1A1 states of SiH2/SiD2 and related transition probabilities based on global potential energy surfaces", "subitem_title_language": "en"}]}, "item_type_id": "5", "owner": "1", "path": ["453/454", "176/488/489"], "permalink_uri": "http://hdl.handle.net/10191/6277", "pubdate": {"attribute_name": "\u516c\u958b\u65e5", "attribute_value": "2008-04-23"}, "publish_date": "2008-04-23", "publish_status": "0", "recid": "2015", "relation": {}, "relation_version_is_last": true, "title": ["Vibrational energies for the X 1A1, \u00c3 1B1, and B 1A1 states of SiH2/SiD2 and related transition probabilities based on global potential energy surfaces"], "weko_shared_id": null}