Quantitative Advances in the Zintl–Klemm Formalism
Identifieur interne : 000762 ( Main/Exploration ); précédent : 000761; suivant : 000763Quantitative Advances in the Zintl–Klemm Formalism
Auteurs : J. Miller [États-Unis] ; W. Schmidt [États-Unis] ; Fei Wang [États-Unis] ; Tae-Soo You [Corée du Sud]Source :
- Structure and Bonding [ 0081-5993 ] ; 2011.
Abstract
Abstract: The Zintl–Klemm formalism has enjoyed tremendous success for rationalizing numerous network- and cluster-based structures involving main group elements. As research continues to explore the applicability of this potentially predictive concept, developments in theoretical and computational chemistry allow the study of larger and heavier molecular and solid-state building blocks to test this powerful formalism semiquantitatively, as well as improved handling of interatomic interactions involving widely disparate elements. Inherent in the Zintl–Klemm formalism is a coexisting tension between anisotropic, covalent bonding interactions, and isotropic, ionic, or metallic bonding forces collected in a system whose equilibrium volume is governed by atomic sizes via core repulsions. This chapter summarizes recent applications and quantitative developments of the Zintl–Klemm formalism, emphasizing results of first-principles calculations on molecules and extended solids, as well as selected experimental results that address the general validity of using this simple concept.
Url:
DOI: 10.1007/430_2010_24
Affiliations:
Links toward previous steps (curation, corpus...)
- to stream Istex, to step Corpus: 000799
- to stream Istex, to step Curation: 000799
- to stream Istex, to step Checkpoint: 000182
- to stream Main, to step Merge: 000764
- to stream Main, to step Curation: 000762
Le document en format XML
<record><TEI wicri:istexFullTextTei="biblStruct"><teiHeader><fileDesc><titleStmt><title xml:lang="en">Quantitative Advances in the Zintl–Klemm Formalism</title><author><name sortKey="Miller, J" sort="Miller, J" uniqKey="Miller J" first="J." last="Miller">J. Miller</name></author><author><name sortKey="Schmidt, W" sort="Schmidt, W" uniqKey="Schmidt W" first="W." last="Schmidt">W. Schmidt</name></author><author><name sortKey="Wang, Fei" sort="Wang, Fei" uniqKey="Wang F" first="Fei" last="Wang">Fei Wang</name></author><author><name sortKey="You, Tae Soo" sort="You, Tae Soo" uniqKey="You T" first="Tae-Soo" last="You">Tae-Soo You</name></author></titleStmt><publicationStmt><idno type="wicri:source">ISTEX</idno><idno type="RBID">ISTEX:21D88CCCA63FF21552C4984A96E722C641882AF3</idno><date when="2011" year="2011">2011</date><idno type="doi">10.1007/430_2010_24</idno><idno type="url">https://api.istex.fr/document/21D88CCCA63FF21552C4984A96E722C641882AF3/fulltext/pdf</idno><idno type="wicri:Area/Istex/Corpus">000799</idno><idno type="wicri:Area/Istex/Curation">000799</idno><idno type="wicri:Area/Istex/Checkpoint">000182</idno><idno type="wicri:doubleKey">0081-5993:2011:Miller J:quantitative:advances:in</idno><idno type="wicri:Area/Main/Merge">000764</idno><idno type="wicri:Area/Main/Curation">000762</idno><idno type="wicri:Area/Main/Exploration">000762</idno></publicationStmt><sourceDesc><biblStruct><analytic><title level="a" type="main" xml:lang="en">Quantitative Advances in the Zintl–Klemm Formalism</title><author><name sortKey="Miller, J" sort="Miller, J" uniqKey="Miller J" first="J." last="Miller">J. Miller</name><affiliation wicri:level="2"><country xml:lang="fr">États-Unis</country><wicri:regionArea>Department of Chemistry, Iowa State University and Ames Laboratory, US-DOE, 321, Spedding Hall, 50011-3111, Ames, IA</wicri:regionArea><placeName><region type="state">Iowa</region></placeName></affiliation><affiliation wicri:level="1"><country wicri:rule="url">États-Unis</country></affiliation></author><author><name sortKey="Schmidt, W" sort="Schmidt, W" uniqKey="Schmidt W" first="W." last="Schmidt">W. Schmidt</name><affiliation wicri:level="2"><country xml:lang="fr">États-Unis</country><wicri:regionArea>Department of Chemistry, Iowa State University and Ames Laboratory, US-DOE, 321, Spedding Hall, 50011-3111, Ames, IA</wicri:regionArea><placeName><region type="state">Iowa</region></placeName></affiliation></author><author><name sortKey="Wang, Fei" sort="Wang, Fei" uniqKey="Wang F" first="Fei" last="Wang">Fei Wang</name><affiliation wicri:level="2"><country xml:lang="fr">États-Unis</country><wicri:regionArea>Department of Chemistry, Iowa State University and Ames Laboratory, US-DOE, 321, Spedding Hall, 50011-3111, Ames, IA</wicri:regionArea><placeName><region type="state">Iowa</region></placeName></affiliation></author><author><name sortKey="You, Tae Soo" sort="You, Tae Soo" uniqKey="You T" first="Tae-Soo" last="You">Tae-Soo You</name><affiliation wicri:level="1"><country xml:lang="fr">Corée du Sud</country><wicri:regionArea>Department of Chemistry, Chungbuk National University, 410 Sungbong-ro, Heungduku, 361-763, Cheongju, Chungbuk</wicri:regionArea><wicri:noRegion>Chungbuk</wicri:noRegion></affiliation></author></analytic><monogr></monogr><series><title level="s">Structure and Bonding</title><imprint><date>2011</date></imprint><idno type="ISSN">0081-5993</idno><idno type="eISSN">1616-8550</idno><idno type="ISSN">0081-5993</idno></series><idno type="istex">21D88CCCA63FF21552C4984A96E722C641882AF3</idno><idno type="DOI">10.1007/430_2010_24</idno><idno type="ChapterID">24</idno><idno type="ChapterID">b430_2010_24</idno></biblStruct></sourceDesc><seriesStmt><idno type="ISSN">0081-5993</idno></seriesStmt></fileDesc><profileDesc><textClass></textClass><langUsage><language ident="en">en</language></langUsage></profileDesc></teiHeader><front><div type="abstract" xml:lang="en">Abstract: The Zintl–Klemm formalism has enjoyed tremendous success for rationalizing numerous network- and cluster-based structures involving main group elements. As research continues to explore the applicability of this potentially predictive concept, developments in theoretical and computational chemistry allow the study of larger and heavier molecular and solid-state building blocks to test this powerful formalism semiquantitatively, as well as improved handling of interatomic interactions involving widely disparate elements. Inherent in the Zintl–Klemm formalism is a coexisting tension between anisotropic, covalent bonding interactions, and isotropic, ionic, or metallic bonding forces collected in a system whose equilibrium volume is governed by atomic sizes via core repulsions. This chapter summarizes recent applications and quantitative developments of the Zintl–Klemm formalism, emphasizing results of first-principles calculations on molecules and extended solids, as well as selected experimental results that address the general validity of using this simple concept.</div></front></TEI><affiliations><list><country><li>Corée du Sud</li><li>États-Unis</li></country><region><li>Iowa</li></region></list><tree><country name="États-Unis"><region name="Iowa"><name sortKey="Miller, J" sort="Miller, J" uniqKey="Miller J" first="J." last="Miller">J. Miller</name></region><name sortKey="Miller, J" sort="Miller, J" uniqKey="Miller J" first="J." last="Miller">J. Miller</name><name sortKey="Schmidt, W" sort="Schmidt, W" uniqKey="Schmidt W" first="W." last="Schmidt">W. Schmidt</name><name sortKey="Wang, Fei" sort="Wang, Fei" uniqKey="Wang F" first="Fei" last="Wang">Fei Wang</name></country><country name="Corée du Sud"><noRegion><name sortKey="You, Tae Soo" sort="You, Tae Soo" uniqKey="You T" first="Tae-Soo" last="You">Tae-Soo You</name></noRegion></country></tree></affiliations></record>Pour manipuler ce document sous Unix (Dilib)
EXPLOR_STEP=$WICRI_ROOT/Ticri/CIDE/explor/CyberinfraV1/Data/Main/Exploration
HfdSelect -h $EXPLOR_STEP/biblio.hfd -nk 000762 | SxmlIndent | more
Ou
HfdSelect -h $EXPLOR_AREA/Data/Main/Exploration/biblio.hfd -nk 000762 | SxmlIndent | more
Pour mettre un lien sur cette page dans le réseau Wicri
{{Explor lien
|wiki= Ticri/CIDE
|area= CyberinfraV1
|flux= Main
|étape= Exploration
|type= RBID
|clé= ISTEX:21D88CCCA63FF21552C4984A96E722C641882AF3
|texte= Quantitative Advances in the Zintl–Klemm Formalism
}}
| This area was generated with Dilib version V0.6.25. |  |