Spherical Harmonics의 전개방법에 의한 간단한 분자의 쌍극자모멘트의 계산
The dipole moments for $NH_3$, HF, CO, HCHO, HCN, PO, $PO^-\;and\;H_2O$ molecules are calculated, using the method for evaluation of the dipole moment matrix elements by the expansion method for spherical harmonics. The calculated dipole moments in this work are closer to the experimental values tha...
Gespeichert in:
| Veröffentlicht in: | Journal of the Korean Chemical Society 1978, Vol.22 (6), p.357-364 |
|---|---|
| Hauptverfasser: | , |
| Format: | Artikel |
| Sprache: | kor |
| Online-Zugang: | Volltext |
| Tags: |
Tag hinzufügen
Keine Tags, Fügen Sie den ersten Tag hinzu!
|
| container_end_page | 364 |
|---|---|
| container_issue | 6 |
| container_start_page | 357 |
| container_title | Journal of the Korean Chemical Society |
| container_volume | 22 |
| creator | 안상운(Sangwoon Ahn) 박병빈(Byong Bin Park) |
| description | The dipole moments for $NH_3$, HF, CO, HCHO, HCN, PO, $PO^-\;and\;H_2O$ molecules are calculated, using the method for evaluation of the dipole moment matrix elements by the expansion method for spherical harmonics. The calculated dipole moments in this work are closer to the experimental values than those of the other work. Spherical harmonics의 전개방법에 의하여 쌍극자모멘트의 행렬요소를 계산하는 방법을 사용하여 $NH_3$, HF, CO, HCHO, HCN, PO, $PO^-\;및\;H_2O$분자의 쌍극자모멘트를 계산하였다. 이 방법에 의하여 계산한 쌍극자모멘트의 값이 다른 방법의 값보다 실험치에 가까웠다. |
| format | Article |
| fullrecord | <record><control><sourceid>nurimedia_kisti</sourceid><recordid>TN_cdi_kisti_ndsl_JAKO197813464503698</recordid><sourceformat>XML</sourceformat><sourcesystem>PC</sourcesystem><nurid>NODE11540883</nurid><sourcerecordid>NODE11540883</sourcerecordid><originalsourceid>FETCH-LOGICAL-k823-6682e041ad43b14d687b94524d41d6638218913df0b46eba1330a3dd0e59e2233</originalsourceid><addsrcrecordid>eNpFj81Kw0AcxBdRsNS-Qy4eA7v57242x1KrVYs92LNh093i0g9LogevkpNa6KXYQxWPraeg4McrJek7mKrgaWZ-DAOzgUqOA9QWDPAmKhFMXNthVGyjShSZADMA18UelNDZ6ehch6Yj-1ZDhoOLoelE-ePMyp_jNJlnyTJ7neYPE6tgq-ncSpM4u1usXfYe50-Tn-r9OP34KkL2ssiWs9Xt55qmb3F-k-ygra7sR7ryp2XU3q-3aw272To4rFWbdk84YHMuHI0pkYpCQKjiwg08yhyqKFGcg3CI8AioLg4o14EkAFiCUlgzTxdHoYx2f2d7Jro0_lBFff-oetwinisIUE4ZBu6J_97wKjQDrYz0R4WR4bV_0tqrE8IoFgLgG-JCcnA</addsrcrecordid><sourcetype>Open Access Repository</sourcetype><iscdi>true</iscdi><recordtype>article</recordtype></control><display><type>article</type><title>Spherical Harmonics의 전개방법에 의한 간단한 분자의 쌍극자모멘트의 계산</title><source>EZB-FREE-00999 freely available EZB journals</source><creator>안상운(Sangwoon Ahn) ; 박병빈(Byong Bin Park)</creator><creatorcontrib>안상운(Sangwoon Ahn) ; 박병빈(Byong Bin Park)</creatorcontrib><description>The dipole moments for $NH_3$, HF, CO, HCHO, HCN, PO, $PO^-\;and\;H_2O$ molecules are calculated, using the method for evaluation of the dipole moment matrix elements by the expansion method for spherical harmonics. The calculated dipole moments in this work are closer to the experimental values than those of the other work. Spherical harmonics의 전개방법에 의하여 쌍극자모멘트의 행렬요소를 계산하는 방법을 사용하여 $NH_3$, HF, CO, HCHO, HCN, PO, $PO^-\;및\;H_2O$분자의 쌍극자모멘트를 계산하였다. 이 방법에 의하여 계산한 쌍극자모멘트의 값이 다른 방법의 값보다 실험치에 가까웠다.</description><identifier>ISSN: 1017-2548</identifier><identifier>EISSN: 2234-8530</identifier><language>kor</language><publisher>대한화학회</publisher><ispartof>Journal of the Korean Chemical Society, 1978, Vol.22 (6), p.357-364</ispartof><lds50>peer_reviewed</lds50><oa>free_for_read</oa><woscitedreferencessubscribed>false</woscitedreferencessubscribed></display><links><openurl>$$Topenurl_article</openurl><openurlfulltext>$$Topenurlfull_article</openurlfulltext><thumbnail>$$Tsyndetics_thumb_exl</thumbnail><link.rule.ids>230,314,780,784,885,4024</link.rule.ids></links><search><creatorcontrib>안상운(Sangwoon Ahn)</creatorcontrib><creatorcontrib>박병빈(Byong Bin Park)</creatorcontrib><title>Spherical Harmonics의 전개방법에 의한 간단한 분자의 쌍극자모멘트의 계산</title><title>Journal of the Korean Chemical Society</title><addtitle>Journal of the Korean Chemical Society</addtitle><description>The dipole moments for $NH_3$, HF, CO, HCHO, HCN, PO, $PO^-\;and\;H_2O$ molecules are calculated, using the method for evaluation of the dipole moment matrix elements by the expansion method for spherical harmonics. The calculated dipole moments in this work are closer to the experimental values than those of the other work. Spherical harmonics의 전개방법에 의하여 쌍극자모멘트의 행렬요소를 계산하는 방법을 사용하여 $NH_3$, HF, CO, HCHO, HCN, PO, $PO^-\;및\;H_2O$분자의 쌍극자모멘트를 계산하였다. 이 방법에 의하여 계산한 쌍극자모멘트의 값이 다른 방법의 값보다 실험치에 가까웠다.</description><issn>1017-2548</issn><issn>2234-8530</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>1978</creationdate><recordtype>article</recordtype><sourceid>JDI</sourceid><recordid>eNpFj81Kw0AcxBdRsNS-Qy4eA7v57242x1KrVYs92LNh093i0g9LogevkpNa6KXYQxWPraeg4McrJek7mKrgaWZ-DAOzgUqOA9QWDPAmKhFMXNthVGyjShSZADMA18UelNDZ6ehch6Yj-1ZDhoOLoelE-ePMyp_jNJlnyTJ7neYPE6tgq-ncSpM4u1usXfYe50-Tn-r9OP34KkL2ssiWs9Xt55qmb3F-k-ygra7sR7ryp2XU3q-3aw272To4rFWbdk84YHMuHI0pkYpCQKjiwg08yhyqKFGcg3CI8AioLg4o14EkAFiCUlgzTxdHoYx2f2d7Jro0_lBFff-oetwinisIUE4ZBu6J_97wKjQDrYz0R4WR4bV_0tqrE8IoFgLgG-JCcnA</recordid><startdate>1978</startdate><enddate>1978</enddate><creator>안상운(Sangwoon Ahn)</creator><creator>박병빈(Byong Bin Park)</creator><general>대한화학회</general><scope>DBRKI</scope><scope>TDB</scope><scope>JDI</scope></search><sort><creationdate>1978</creationdate><title>Spherical Harmonics의 전개방법에 의한 간단한 분자의 쌍극자모멘트의 계산</title><author>안상운(Sangwoon Ahn) ; 박병빈(Byong Bin Park)</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-k823-6682e041ad43b14d687b94524d41d6638218913df0b46eba1330a3dd0e59e2233</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>kor</language><creationdate>1978</creationdate><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>안상운(Sangwoon Ahn)</creatorcontrib><creatorcontrib>박병빈(Byong Bin Park)</creatorcontrib><collection>DBPIA - 디비피아</collection><collection>DBPIA</collection><collection>KoreaScience</collection><jtitle>Journal of the Korean Chemical Society</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>안상운(Sangwoon Ahn)</au><au>박병빈(Byong Bin Park)</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>Spherical Harmonics의 전개방법에 의한 간단한 분자의 쌍극자모멘트의 계산</atitle><jtitle>Journal of the Korean Chemical Society</jtitle><addtitle>Journal of the Korean Chemical Society</addtitle><date>1978</date><risdate>1978</risdate><volume>22</volume><issue>6</issue><spage>357</spage><epage>364</epage><pages>357-364</pages><issn>1017-2548</issn><eissn>2234-8530</eissn><abstract>The dipole moments for $NH_3$, HF, CO, HCHO, HCN, PO, $PO^-\;and\;H_2O$ molecules are calculated, using the method for evaluation of the dipole moment matrix elements by the expansion method for spherical harmonics. The calculated dipole moments in this work are closer to the experimental values than those of the other work. Spherical harmonics의 전개방법에 의하여 쌍극자모멘트의 행렬요소를 계산하는 방법을 사용하여 $NH_3$, HF, CO, HCHO, HCN, PO, $PO^-\;및\;H_2O$분자의 쌍극자모멘트를 계산하였다. 이 방법에 의하여 계산한 쌍극자모멘트의 값이 다른 방법의 값보다 실험치에 가까웠다.</abstract><pub>대한화학회</pub><tpages>8</tpages><oa>free_for_read</oa></addata></record> |
| fulltext | fulltext |
| identifier | ISSN: 1017-2548 |
| ispartof | Journal of the Korean Chemical Society, 1978, Vol.22 (6), p.357-364 |
| issn | 1017-2548 2234-8530 |
| language | kor |
| recordid | cdi_kisti_ndsl_JAKO197813464503698 |
| source | EZB-FREE-00999 freely available EZB journals |
| title | Spherical Harmonics의 전개방법에 의한 간단한 분자의 쌍극자모멘트의 계산 |
| url | https://sfx.bib-bvb.de/sfx_tum?ctx_ver=Z39.88-2004&ctx_enc=info:ofi/enc:UTF-8&ctx_tim=2025-01-08T00%3A41%3A29IST&url_ver=Z39.88-2004&url_ctx_fmt=infofi/fmt:kev:mtx:ctx&rfr_id=info:sid/primo.exlibrisgroup.com:primo3-Article-nurimedia_kisti&rft_val_fmt=info:ofi/fmt:kev:mtx:journal&rft.genre=article&rft.atitle=Spherical%20Harmonics%EC%9D%98%20%EC%A0%84%EA%B0%9C%EB%B0%A9%EB%B2%95%EC%97%90%20%EC%9D%98%ED%95%9C%20%EA%B0%84%EB%8B%A8%ED%95%9C%20%EB%B6%84%EC%9E%90%EC%9D%98%20%EC%8C%8D%EA%B7%B9%EC%9E%90%EB%AA%A8%EB%A9%98%ED%8A%B8%EC%9D%98%20%EA%B3%84%EC%82%B0&rft.jtitle=Journal%20of%20the%20Korean%20Chemical%20Society&rft.au=%EC%95%88%EC%83%81%EC%9A%B4(Sangwoon%20Ahn)&rft.date=1978&rft.volume=22&rft.issue=6&rft.spage=357&rft.epage=364&rft.pages=357-364&rft.issn=1017-2548&rft.eissn=2234-8530&rft_id=info:doi/&rft_dat=%3Cnurimedia_kisti%3ENODE11540883%3C/nurimedia_kisti%3E%3Curl%3E%3C/url%3E&disable_directlink=true&sfx.directlink=off&sfx.report_link=0&rft_id=info:oai/&rft_id=info:pmid/&rft_nurid=NODE11540883&rfr_iscdi=true |