{"created":"2023-05-15T14:48:29.714497+00:00","id":66441,"links":{},"metadata":{"_buckets":{"deposit":"a83ac383-7bd6-41c8-a25b-1a292c928574"},"_deposit":{"created_by":1,"id":"66441","owners":[1],"pid":{"revision_id":0,"type":"depid","value":"66441"},"status":"published"},"_oai":{"id":"oai:repo.qst.go.jp:00066441","sets":["10:29"]},"author_link":["653678","653679","653680","653676","653677","653681"],"item_10005_date_7":{"attribute_name":"発表年月日","attribute_value_mlt":[{"subitem_date_issued_datetime":"2017-09-17","subitem_date_issued_type":"Issued"}]},"item_10005_description_5":{"attribute_name":"抄録","attribute_value_mlt":[{"subitem_description":"エタノールのトンネルイオン化率を密度汎関数理論に基づいて計算した。その結果、分子と電場の相対角度によってはHOMO-1の軌道形状が大きく変更を受け、イオン化率に影響を及ぼしていることが分かった。得られた結果を実験と比較したところ、実験値をよく再現していることが示された。これより、これまで束縛エネルギーと分子軌道形状で決定されるとされていたトンネルイオン化過程に軌道の偏重という新たな要素があることが明らかとなった","subitem_description_type":"Abstract"}]},"item_10005_description_6":{"attribute_name":"会議概要（会議名, 開催地, 会期, 主催者等）","attribute_value_mlt":[{"subitem_description":"分子科学討論会","subitem_description_type":"Other"}]},"item_access_right":{"attribute_name":"アクセス権","attribute_value_mlt":[{"subitem_access_right":"metadata only access","subitem_access_right_uri":"http://purl.org/coar/access_right/c_14cb"}]},"item_creator":{"attribute_name":"著者","attribute_type":"creator","attribute_value_mlt":[{"creatorNames":[{"creatorName":"乙部, 智仁"}],"nameIdentifiers":[{"nameIdentifier":"653676","nameIdentifierScheme":"WEKO"}]},{"creatorNames":[{"creatorName":"赤木, 浩"}],"nameIdentifiers":[{"nameIdentifier":"653677","nameIdentifierScheme":"WEKO"}]},{"creatorNames":[{"creatorName":"板倉, 隆二"}],"nameIdentifiers":[{"nameIdentifier":"653678","nameIdentifierScheme":"WEKO"}]},{"creatorNames":[{"creatorName":"乙部 智仁","creatorNameLang":"en"}],"nameIdentifiers":[{"nameIdentifier":"653679","nameIdentifierScheme":"WEKO"}]},{"creatorNames":[{"creatorName":"赤木 浩","creatorNameLang":"en"}],"nameIdentifiers":[{"nameIdentifier":"653680","nameIdentifierScheme":"WEKO"}]},{"creatorNames":[{"creatorName":"板倉 隆二","creatorNameLang":"en"}],"nameIdentifiers":[{"nameIdentifier":"653681","nameIdentifierScheme":"WEKO"}]}]},"item_language":{"attribute_name":"言語","attribute_value_mlt":[{"subitem_language":"jpn"}]},"item_resource_type":{"attribute_name":"資源タイプ","attribute_value_mlt":[{"resourcetype":"conference object","resourceuri":"http://purl.org/coar/resource_type/c_c94f"}]},"item_title":"エタノールのトンネルイオン化における分子軌道の混合・反転現象","item_titles":{"attribute_name":"タイトル","attribute_value_mlt":[{"subitem_title":"エタノールのトンネルイオン化における分子軌道の混合・反転現象"}]},"item_type_id":"10005","owner":"1","path":["29"],"pubdate":{"attribute_name":"公開日","attribute_value":"2017-09-19"},"publish_date":"2017-09-19","publish_status":"0","recid":"66441","relation_version_is_last":true,"title":["エタノールのトンネルイオン化における分子軌道の混合・反転現象"],"weko_creator_id":"1","weko_shared_id":-1},"updated":"2023-05-15T20:48:54.953557+00:00"}