WEKO3
アイテム
{"_buckets": {"deposit": "b636c9ae-385e-448b-ad92-5d95609a6201"}, "_deposit": {"created_by": 18, "id": "5450", "owners": [18], "pid": {"revision_id": 0, "type": "depid", "value": "5450"}, "status": "published"}, "_oai": {"id": "oai:muroran-it.repo.nii.ac.jp:00005450", "sets": ["46"]}, "author_link": ["10888"], "item_79_biblio_info_10": {"attribute_name": "書誌情報", "attribute_value_mlt": [{"bibliographicIssueDates": {"bibliographicIssueDate": "1985-12-15", "bibliographicIssueDateType": "Issued"}, "bibliographicIssueNumber": "12", "bibliographicPageEnd": "6303", "bibliographicPageStart": "6301", "bibliographicVolumeNumber": "83", "bibliographic_titles": [{"bibliographic_title": "The journal of chemical physics", "bibliographic_titleLang": "en"}]}]}, "item_79_description_23": {"attribute_name": "フォーマット", "attribute_value_mlt": [{"subitem_description": "application/pdf", "subitem_description_type": "Other"}]}, "item_79_description_7": {"attribute_name": "抄録", "attribute_value_mlt": [{"subitem_description": "A zero potential energy expression, which is a possible partner to the zero momentum energy expression presented previously, is proposed and discussed as a criterion for assessing the accuracy of approximate wave functions. Applicability of these criteria is illustrated and compared for several approximate wave functions for the 1sσ_g and 2pσ_u states of the {H^+}_{2} molecule.", "subitem_description_language": "en", "subitem_description_type": "Abstract"}]}, "item_79_link_17": {"attribute_name": "出版者版へのリンク", "attribute_value_mlt": [{"subitem_link_text": "10.1063/1.449580", "subitem_link_url": "https://doi.org/10.1063/1.449580"}]}, "item_79_publisher_11": {"attribute_name": "出版者", "attribute_value_mlt": [{"subitem_publisher": "American Institute of Physics", "subitem_publisher_language": "en"}]}, "item_79_relation_15": {"attribute_name": "論文ID(NAID)", "attribute_value_mlt": [{"subitem_relation_type": "isIdenticalTo", "subitem_relation_type_id": {"subitem_relation_type_id_text": "120003895634", "subitem_relation_type_select": "NAID"}}]}, "item_79_relation_18": {"attribute_name": "DOI", "attribute_value_mlt": [{"subitem_relation_type": "isIdenticalTo", "subitem_relation_type_id": {"subitem_relation_type_id_text": "10.1063/1.449580", "subitem_relation_type_select": "DOI"}}]}, "item_79_rights_19": {"attribute_name": "権利", "attribute_value_mlt": [{"subitem_rights": "Copyright 1985 American Institute of Physics. This article may be downloaded for personal use only. Any other use requires prior permission of the author and the American Institute of Physics. The following article appeared in J. Chem. Phys. 83, 6301 (1985) and may be found at http://link.aip.org/link/?jcp/83/6301", "subitem_rights_language": "en"}]}, "item_79_source_id_12": {"attribute_name": "ISSN", "attribute_value_mlt": [{"subitem_source_identifier": "00219606", "subitem_source_identifier_type": "PISSN"}, {"subitem_source_identifier": "10897690", "subitem_source_identifier_type": "EISSN"}]}, "item_79_source_id_14": {"attribute_name": "書誌レコードID", "attribute_value_mlt": [{"subitem_source_identifier": "AA00694991", "subitem_source_identifier_type": "NCID"}, {"subitem_source_identifier": "AA11868256", "subitem_source_identifier_type": "NCID"}]}, "item_79_subject_9": {"attribute_name": "日本十進分類法", "attribute_value_mlt": [{"subitem_subject": "431.19", "subitem_subject_scheme": "NDC"}]}, "item_79_text_4": {"attribute_name": "著者ID(非表示)", "attribute_value_mlt": [{"subitem_text_value": "1000090113688"}]}, "item_79_version_type_21": {"attribute_name": "著者版フラグ", "attribute_value_mlt": [{"subitem_version_resource": "http://purl.org/coar/version/c_970fb48d4fbd8a85", "subitem_version_type": "VoR"}]}, "item_access_right": {"attribute_name": "アクセス権", "attribute_value_mlt": [{"subitem_access_right": "open access", "subitem_access_right_uri": "http://purl.org/coar/access_right/c_abf2"}]}, "item_creator": {"attribute_name": "著者", "attribute_type": "creator", "attribute_value_mlt": [{"creatorAffiliations": [{"affiliationNameIdentifiers": [], "affiliationNames": [{"affiliationName": "", "affiliationNameLang": "ja"}]}], "creatorNames": [{"creatorName": "KOGA, Toshikatsu", "creatorNameLang": "en"}, {"creatorName": "古賀, 俊勝", "creatorNameLang": "ja"}, {"creatorName": "コガ, トシカツ", "creatorNameLang": "ja-Kana"}], "familyNames": [{"familyName": "KOGA", "familyNameLang": "en"}, {"familyName": "古賀", "familyNameLang": "ja"}, {"familyName": "コガ", "familyNameLang": "ja-Kana"}], "givenNames": [{"givenName": " Toshikatsu", "givenNameLang": "en"}, {"givenName": "俊勝", "givenNameLang": "ja"}, {"givenName": "トシカツ", "givenNameLang": "ja-Kana"}], "nameIdentifiers": [{"nameIdentifier": "10888", "nameIdentifierScheme": "WEKO"}, {"nameIdentifier": "1000090113688", "nameIdentifierScheme": "NRID", "nameIdentifierURI": "https://nrid.nii.ac.jp/ja/nrid/1000090113688"}]}]}, "item_files": {"attribute_name": "ファイル情報", "attribute_type": "file", "attribute_value_mlt": [{"accessrole": "open_date", "date": [{"dateType": "Available", "dateValue": "2016-02-15"}], "displaytype": "detail", "download_preview_message": "", "file_order": 0, "filename": "36_JCP83_1985_6301.pdf", "filesize": [{"value": "384.9 kB"}], "format": "application/pdf", "future_date_message": "", "is_thumbnail": false, "licensetype": "license_note", "mimetype": "application/pdf", "size": 384900.0, "url": {"label": "36_JCP83_1985_6301.pdf", "objectType": "fulltext", "url": "https://muroran-it.repo.nii.ac.jp/record/5450/files/36_JCP83_1985_6301.pdf"}, "version_id": "3406d862-47b9-43be-b775-f59c5f8845f8"}]}, "item_keyword": {"attribute_name": "キーワード", "attribute_value_mlt": [{"subitem_subject": "WAVE FUNCTIONS", "subitem_subject_language": "en", "subitem_subject_scheme": "Other"}, {"subitem_subject": "POTENTIAL ENERGY", "subitem_subject_language": "en", "subitem_subject_scheme": "Other"}, {"subitem_subject": "HYDROGEN IONS 1 PLUS", "subitem_subject_language": "en", "subitem_subject_scheme": "Other"}, {"subitem_subject": "MOLECULAR IONS", "subitem_subject_language": "en", "subitem_subject_scheme": "Other"}, {"subitem_subject": "ELECTRONIC STRUCTURE", "subitem_subject_language": "en", "subitem_subject_scheme": "Other"}]}, "item_language": {"attribute_name": "言語", "attribute_value_mlt": [{"subitem_language": "eng"}]}, "item_resource_type": {"attribute_name": "資源タイプ", "attribute_value_mlt": [{"resourcetype": "journal article", "resourceuri": "http://purl.org/coar/resource_type/c_6501"}]}, "item_title": "Zero potential energy criterion for approximate wave functions", "item_titles": {"attribute_name": "タイトル", "attribute_value_mlt": [{"subitem_title": "Zero potential energy criterion for approximate wave functions", "subitem_title_language": "en"}]}, "item_type_id": "79", "owner": "18", "path": ["46"], "permalink_uri": "http://hdl.handle.net/10258/935", "pubdate": {"attribute_name": "PubDate", "attribute_value": "2012-03-16"}, "publish_date": "2012-03-16", "publish_status": "0", "recid": "5450", "relation": {}, "relation_version_is_last": true, "title": ["Zero potential energy criterion for approximate wave functions"], "weko_shared_id": -1}
Zero potential energy criterion for approximate wave functions
http://hdl.handle.net/10258/935
http://hdl.handle.net/10258/9354b8a8735-ef7b-426b-91fe-fc75d27493c2
名前 / ファイル | ライセンス | アクション |
---|---|---|
36_JCP83_1985_6301.pdf (384.9 kB)
|
|
Item type | 学術雑誌論文 / Journal Article.(1) | |||||
---|---|---|---|---|---|---|
公開日 | 2012-03-16 | |||||
タイトル | ||||||
言語 | en | |||||
タイトル | Zero potential energy criterion for approximate wave functions | |||||
言語 | ||||||
言語 | eng | |||||
キーワード | ||||||
言語 | en | |||||
主題Scheme | Other | |||||
主題 | WAVE FUNCTIONS | |||||
キーワード | ||||||
言語 | en | |||||
主題Scheme | Other | |||||
主題 | POTENTIAL ENERGY | |||||
キーワード | ||||||
言語 | en | |||||
主題Scheme | Other | |||||
主題 | HYDROGEN IONS 1 PLUS | |||||
キーワード | ||||||
言語 | en | |||||
主題Scheme | Other | |||||
主題 | MOLECULAR IONS | |||||
キーワード | ||||||
言語 | en | |||||
主題Scheme | Other | |||||
主題 | ELECTRONIC STRUCTURE | |||||
資源タイプ | ||||||
資源タイプ識別子 | http://purl.org/coar/resource_type/c_6501 | |||||
資源タイプ | journal article | |||||
アクセス権 | ||||||
アクセス権 | open access | |||||
アクセス権URI | http://purl.org/coar/access_right/c_abf2 | |||||
著者 |
古賀, 俊勝
× 古賀, 俊勝 |
|||||
抄録 | ||||||
内容記述タイプ | Abstract | |||||
内容記述 | A zero potential energy expression, which is a possible partner to the zero momentum energy expression presented previously, is proposed and discussed as a criterion for assessing the accuracy of approximate wave functions. Applicability of these criteria is illustrated and compared for several approximate wave functions for the 1sσ_g and 2pσ_u states of the {H^+}_{2} molecule. | |||||
言語 | en | |||||
書誌情報 |
en : The journal of chemical physics 巻 83, 号 12, p. 6301-6303, 発行日 1985-12-15 |
|||||
出版者 | ||||||
言語 | en | |||||
出版者 | American Institute of Physics | |||||
出版者版へのリンク | ||||||
10.1063/1.449580 | ||||||
https://doi.org/10.1063/1.449580 | ||||||
DOI | ||||||
関連タイプ | isIdenticalTo | |||||
識別子タイプ | DOI | |||||
関連識別子 | 10.1063/1.449580 | |||||
論文ID(NAID) | ||||||
関連タイプ | isIdenticalTo | |||||
識別子タイプ | NAID | |||||
関連識別子 | 120003895634 | |||||
日本十進分類法 | ||||||
主題Scheme | NDC | |||||
主題 | 431.19 | |||||
ISSN | ||||||
収録物識別子タイプ | PISSN | |||||
収録物識別子 | 00219606 | |||||
ISSN | ||||||
収録物識別子タイプ | EISSN | |||||
収録物識別子 | 10897690 | |||||
書誌レコードID | ||||||
収録物識別子タイプ | NCID | |||||
収録物識別子 | AA00694991 | |||||
書誌レコードID | ||||||
収録物識別子タイプ | NCID | |||||
収録物識別子 | AA11868256 | |||||
権利 | ||||||
言語 | en | |||||
権利情報 | Copyright 1985 American Institute of Physics. This article may be downloaded for personal use only. Any other use requires prior permission of the author and the American Institute of Physics. The following article appeared in J. Chem. Phys. 83, 6301 (1985) and may be found at http://link.aip.org/link/?jcp/83/6301 | |||||
著者版フラグ | ||||||
出版タイプ | VoR | |||||
出版タイプResource | http://purl.org/coar/version/c_970fb48d4fbd8a85 | |||||
フォーマット | ||||||
内容記述タイプ | Other | |||||
内容記述 | application/pdf |