BaTiO3: Energy, geometrical and electronic structure, relationship between optical constant and density from first-principles calculations
- Auteur
- LIU, Qi-Jun1 ; ZHANG, Ning-Chao2 ; LIU, Fu-Sheng2 ; WANG, Hong-Yan2 ; LIU, Zheng-Tang3
[1] Bond and Band Engineering Group, Institute of High Temperature and High Pressure Physics, School of Physical Science and Technology, Southwest Jiaotong University, Chengdu, Sichuan 610031, China
[2] Institute of High Temperature and High Pressure Physics, Southwest Jiaotong University, Chengdu, Sichuan 610031, China
[3] State Key Laboratory of Solidification Processing, School of Materials Science and Engineering, Northwestern Polytechnical University, Xi'an, Shaanxi 710072, China - Source
Optical materials (Amsterdam). 2013, Vol 35, Num 12, pp 2629-2637, 9 p ; ref : 84 ref
- ISSN
- 0925-3467
- Domaine scientifique
- Optics; Condensed state physics
- Editeur
- Elsevier, Oxford
- Pays de publication
- United Kingdom
- Type de document
- Article
- Langue
- English
- Mot clé auteur
- BaTiO3 Density-functional theory Electronic structure Optical properties
- Mot clé (fr)
- Composé ternaire Constante optique Densité électron Densité état Etat fondamental Indice réfraction Matériau optique Méthode fonctionnelle densité Propriété optique Structure bande Structure électronique Titanate de baryum 4270 Ba O Ti BaTiO3
- Mot clé (en)
- Ternary compounds Optical constants Electron density Density of states Ground states Refractive index Optical materials Density functional method Optical properties Band structure Electronic structure Barium titanates
- Mot clé (es)
- Densidad estado
- Classification
- Pascal
- 001 Sciences exactes et technologie / 001B Physique / 001B40 Domaines classiques de la physique (y compris les applications) / 001B40B Optique / 001B40B70 Matériaux optiques
- Discipline
- Physics : optics
- Provenance
- Inist-CNRS
- Base de données
- PASCAL
- Identifiant INIST
- 27831032
Sauf mention contraire ci-dessus, le contenu de cette notice bibliographique peut être utilisé dans le cadre d’une licence CC BY 4.0 Inist-CNRS / Unless otherwise stated above, the content of this bibliographic record may be used under a CC BY 4.0 licence by Inist-CNRS / A menos que se haya señalado antes, el contenido de este registro bibliográfico puede ser utilizado al amparo de una licencia CC BY 4.0 Inist-CNRS
Installer sur votre navigateur
"O:13:\"PanistOpenUrl\":36:{s:10:\"\u0000*\u0000openUrl\";N;s:6:\"\u0000*\u0000idc\";N;s:6:\"\u0000*\u0000fmt\";s:7:\"journal\";s:6:\"\u0000*\u0000doi\";s:0:\"\";s:6:\"\u0000*\u0000pii\";s:0:\"\";s:7:\"\u0000*\u0000pmid\";s:0:\"\";s:9:\"\u0000*\u0000atitle\";s:138:\"BaTiO3: Energy, geometrical and electronic structure, relationship between optical constant and density from first-principles calculations\";s:9:\"\u0000*\u0000jtitle\";s:29:\"Optical materials (Amsterdam)\";s:9:\"\u0000*\u0000stitle\";s:19:\"Opt. mater. (Amst.)\";s:7:\"\u0000*\u0000date\";s:4:\"2013\";s:9:\"\u0000*\u0000volume\";s:2:\"35\";s:8:\"\u0000*\u0000issue\";s:2:\"12\";s:8:\"\u0000*\u0000spage\";s:4:\"2629\";s:8:\"\u0000*\u0000epage\";s:4:\"2637\";s:8:\"\u0000*\u0000pages\";s:0:\"\";s:7:\"\u0000*\u0000issn\";s:9:\"0925-3467\";s:8:\"\u0000*\u0000eissn\";s:0:\"\";s:9:\"\u0000*\u0000aulast\";s:3:\"LIU\";s:10:\"\u0000*\u0000aufirst\";s:6:\"Qi-Jun\";s:9:\"\u0000*\u0000auinit\";s:0:\"\";s:10:\"\u0000*\u0000auinitm\";s:0:\"\";s:5:\"\u0000*\u0000au\";a:4:{i:0;s:16:\"ZHANG, Ning-Chao\";i:1;s:13:\"LIU, Fu-Sheng\";i:2;s:14:\"WANG, Hong-Yan\";i:3;s:15:\"LIU, Zheng-Tang\";}s:9:\"\u0000*\u0000aucorp\";s:0:\"\";s:7:\"\u0000*\u0000isbn\";s:0:\"\";s:8:\"\u0000*\u0000coden\";s:0:\"\";s:8:\"\u0000*\u0000genre\";s:7:\"article\";s:7:\"\u0000*\u0000part\";s:0:\"\";s:9:\"\u0000*\u0000btitle\";s:0:\"\";s:8:\"\u0000*\u0000title\";s:138:\"BaTiO3: Energy, geometrical and electronic structure, relationship between optical constant and density from first-principles calculations\";s:8:\"\u0000*\u0000place\";s:6:\"Oxford\";s:6:\"\u0000*\u0000pub\";s:8:\"Elsevier\";s:10:\"\u0000*\u0000edition\";s:0:\"\";s:9:\"\u0000*\u0000tpages\";s:1:\"9\";s:9:\"\u0000*\u0000series\";s:0:\"\";s:8:\"\u0000*\u0000proxy\";s:30:\"http:\/\/proxyout.inist.fr:8080\/\";s:12:\"\u0000*\u0000integrite\";b:1;}"
Accès par Panist
"O:12:\"IstexOpenUrl\":35:{s:10:\"\u0000*\u0000openUrl\";N;s:6:\"\u0000*\u0000fmt\";s:7:\"journal\";s:6:\"\u0000*\u0000doi\";s:0:\"\";s:6:\"\u0000*\u0000pii\";s:0:\"\";s:7:\"\u0000*\u0000pmid\";s:0:\"\";s:9:\"\u0000*\u0000atitle\";s:138:\"BaTiO3: Energy, geometrical and electronic structure, relationship between optical constant and density from first-principles calculations\";s:9:\"\u0000*\u0000jtitle\";s:29:\"Optical materials (Amsterdam)\";s:9:\"\u0000*\u0000stitle\";s:19:\"Opt. mater. (Amst.)\";s:7:\"\u0000*\u0000date\";s:4:\"2013\";s:9:\"\u0000*\u0000volume\";s:2:\"35\";s:8:\"\u0000*\u0000issue\";s:2:\"12\";s:8:\"\u0000*\u0000spage\";s:4:\"2629\";s:8:\"\u0000*\u0000epage\";s:4:\"2637\";s:8:\"\u0000*\u0000pages\";s:0:\"\";s:7:\"\u0000*\u0000issn\";s:9:\"0925-3467\";s:8:\"\u0000*\u0000eissn\";s:0:\"\";s:9:\"\u0000*\u0000aulast\";s:3:\"LIU\";s:10:\"\u0000*\u0000aufirst\";s:6:\"Qi-Jun\";s:9:\"\u0000*\u0000auinit\";s:0:\"\";s:10:\"\u0000*\u0000auinitm\";s:0:\"\";s:5:\"\u0000*\u0000au\";a:4:{i:0;s:16:\"ZHANG, Ning-Chao\";i:1;s:13:\"LIU, Fu-Sheng\";i:2;s:14:\"WANG, Hong-Yan\";i:3;s:15:\"LIU, Zheng-Tang\";}s:9:\"\u0000*\u0000aucorp\";s:0:\"\";s:7:\"\u0000*\u0000isbn\";s:0:\"\";s:8:\"\u0000*\u0000coden\";s:0:\"\";s:8:\"\u0000*\u0000genre\";s:7:\"article\";s:7:\"\u0000*\u0000part\";s:0:\"\";s:9:\"\u0000*\u0000btitle\";s:0:\"\";s:8:\"\u0000*\u0000title\";s:138:\"BaTiO3: Energy, geometrical and electronic structure, relationship between optical constant and density from first-principles calculations\";s:8:\"\u0000*\u0000place\";s:6:\"Oxford\";s:6:\"\u0000*\u0000pub\";s:8:\"Elsevier\";s:10:\"\u0000*\u0000edition\";s:0:\"\";s:9:\"\u0000*\u0000tpages\";s:1:\"9\";s:9:\"\u0000*\u0000series\";s:0:\"\";s:8:\"\u0000*\u0000proxy\";s:30:\"http:\/\/proxyout.inist.fr:8080\/\";s:12:\"\u0000*\u0000integrite\";b:1;}"
Accès par Istex
"O:16:\"EuropePMCOpenUrl\":35:{s:10:\"\u0000*\u0000openUrl\";N;s:6:\"\u0000*\u0000fmt\";s:7:\"journal\";s:6:\"\u0000*\u0000doi\";s:0:\"\";s:6:\"\u0000*\u0000pii\";s:0:\"\";s:7:\"\u0000*\u0000pmid\";s:0:\"\";s:9:\"\u0000*\u0000atitle\";s:138:\"BaTiO3: Energy, geometrical and electronic structure, relationship between optical constant and density from first-principles calculations\";s:9:\"\u0000*\u0000jtitle\";s:29:\"Optical materials (Amsterdam)\";s:9:\"\u0000*\u0000stitle\";s:19:\"Opt. mater. (Amst.)\";s:7:\"\u0000*\u0000date\";s:4:\"2013\";s:9:\"\u0000*\u0000volume\";s:2:\"35\";s:8:\"\u0000*\u0000issue\";s:2:\"12\";s:8:\"\u0000*\u0000spage\";s:4:\"2629\";s:8:\"\u0000*\u0000epage\";s:4:\"2637\";s:8:\"\u0000*\u0000pages\";s:0:\"\";s:7:\"\u0000*\u0000issn\";s:9:\"0925-3467\";s:8:\"\u0000*\u0000eissn\";s:0:\"\";s:9:\"\u0000*\u0000aulast\";s:3:\"LIU\";s:10:\"\u0000*\u0000aufirst\";s:6:\"Qi-Jun\";s:9:\"\u0000*\u0000auinit\";s:0:\"\";s:10:\"\u0000*\u0000auinitm\";s:0:\"\";s:5:\"\u0000*\u0000au\";a:4:{i:0;s:16:\"ZHANG, Ning-Chao\";i:1;s:13:\"LIU, Fu-Sheng\";i:2;s:14:\"WANG, Hong-Yan\";i:3;s:15:\"LIU, Zheng-Tang\";}s:9:\"\u0000*\u0000aucorp\";s:0:\"\";s:7:\"\u0000*\u0000isbn\";s:0:\"\";s:8:\"\u0000*\u0000coden\";s:0:\"\";s:8:\"\u0000*\u0000genre\";s:7:\"article\";s:7:\"\u0000*\u0000part\";s:0:\"\";s:9:\"\u0000*\u0000btitle\";s:0:\"\";s:8:\"\u0000*\u0000title\";s:138:\"BaTiO3: Energy, geometrical and electronic structure, relationship between optical constant and density from first-principles calculations\";s:8:\"\u0000*\u0000place\";s:6:\"Oxford\";s:6:\"\u0000*\u0000pub\";s:8:\"Elsevier\";s:10:\"\u0000*\u0000edition\";s:0:\"\";s:9:\"\u0000*\u0000tpages\";s:1:\"9\";s:9:\"\u0000*\u0000series\";s:0:\"\";s:8:\"\u0000*\u0000proxy\";s:30:\"http:\/\/proxyout.inist.fr:8080\/\";s:12:\"\u0000*\u0000integrite\";b:1;}"
Accès par Europe PubMed Central
"O:11:\"BaseOpenUrl\":35:{s:10:\"\u0000*\u0000openUrl\";N;s:6:\"\u0000*\u0000fmt\";s:7:\"journal\";s:6:\"\u0000*\u0000doi\";s:0:\"\";s:6:\"\u0000*\u0000pii\";s:0:\"\";s:7:\"\u0000*\u0000pmid\";s:0:\"\";s:9:\"\u0000*\u0000atitle\";s:138:\"BaTiO3: Energy, geometrical and electronic structure, relationship between optical constant and density from first-principles calculations\";s:9:\"\u0000*\u0000jtitle\";s:29:\"Optical materials (Amsterdam)\";s:9:\"\u0000*\u0000stitle\";s:19:\"Opt. mater. (Amst.)\";s:7:\"\u0000*\u0000date\";s:4:\"2013\";s:9:\"\u0000*\u0000volume\";s:2:\"35\";s:8:\"\u0000*\u0000issue\";s:2:\"12\";s:8:\"\u0000*\u0000spage\";s:4:\"2629\";s:8:\"\u0000*\u0000epage\";s:4:\"2637\";s:8:\"\u0000*\u0000pages\";s:0:\"\";s:7:\"\u0000*\u0000issn\";s:9:\"0925-3467\";s:8:\"\u0000*\u0000eissn\";s:0:\"\";s:9:\"\u0000*\u0000aulast\";s:3:\"LIU\";s:10:\"\u0000*\u0000aufirst\";s:6:\"Qi-Jun\";s:9:\"\u0000*\u0000auinit\";s:0:\"\";s:10:\"\u0000*\u0000auinitm\";s:0:\"\";s:5:\"\u0000*\u0000au\";a:4:{i:0;s:16:\"ZHANG, Ning-Chao\";i:1;s:13:\"LIU, Fu-Sheng\";i:2;s:14:\"WANG, Hong-Yan\";i:3;s:15:\"LIU, Zheng-Tang\";}s:9:\"\u0000*\u0000aucorp\";s:0:\"\";s:7:\"\u0000*\u0000isbn\";s:0:\"\";s:8:\"\u0000*\u0000coden\";s:0:\"\";s:8:\"\u0000*\u0000genre\";s:7:\"article\";s:7:\"\u0000*\u0000part\";s:0:\"\";s:9:\"\u0000*\u0000btitle\";s:0:\"\";s:8:\"\u0000*\u0000title\";s:138:\"BaTiO3: Energy, geometrical and electronic structure, relationship between optical constant and density from first-principles calculations\";s:8:\"\u0000*\u0000place\";s:6:\"Oxford\";s:6:\"\u0000*\u0000pub\";s:8:\"Elsevier\";s:10:\"\u0000*\u0000edition\";s:0:\"\";s:9:\"\u0000*\u0000tpages\";s:1:\"9\";s:9:\"\u0000*\u0000series\";s:0:\"\";s:8:\"\u0000*\u0000proxy\";s:30:\"http:\/\/proxyout.inist.fr:8080\/\";s:12:\"\u0000*\u0000integrite\";b:1;}"
Accès par Base Search
"O:12:\"ArXivOpenUrl\":35:{s:10:\"\u0000*\u0000openUrl\";N;s:6:\"\u0000*\u0000fmt\";s:7:\"journal\";s:6:\"\u0000*\u0000doi\";s:0:\"\";s:6:\"\u0000*\u0000pii\";s:0:\"\";s:7:\"\u0000*\u0000pmid\";s:0:\"\";s:9:\"\u0000*\u0000atitle\";s:138:\"BaTiO3: Energy, geometrical and electronic structure, relationship between optical constant and density from first-principles calculations\";s:9:\"\u0000*\u0000jtitle\";s:29:\"Optical materials (Amsterdam)\";s:9:\"\u0000*\u0000stitle\";s:19:\"Opt. mater. (Amst.)\";s:7:\"\u0000*\u0000date\";s:4:\"2013\";s:9:\"\u0000*\u0000volume\";s:2:\"35\";s:8:\"\u0000*\u0000issue\";s:2:\"12\";s:8:\"\u0000*\u0000spage\";s:4:\"2629\";s:8:\"\u0000*\u0000epage\";s:4:\"2637\";s:8:\"\u0000*\u0000pages\";s:0:\"\";s:7:\"\u0000*\u0000issn\";s:9:\"0925-3467\";s:8:\"\u0000*\u0000eissn\";s:0:\"\";s:9:\"\u0000*\u0000aulast\";s:3:\"LIU\";s:10:\"\u0000*\u0000aufirst\";s:6:\"Qi-Jun\";s:9:\"\u0000*\u0000auinit\";s:0:\"\";s:10:\"\u0000*\u0000auinitm\";s:0:\"\";s:5:\"\u0000*\u0000au\";a:4:{i:0;s:16:\"ZHANG, Ning-Chao\";i:1;s:13:\"LIU, Fu-Sheng\";i:2;s:14:\"WANG, Hong-Yan\";i:3;s:15:\"LIU, Zheng-Tang\";}s:9:\"\u0000*\u0000aucorp\";s:0:\"\";s:7:\"\u0000*\u0000isbn\";s:0:\"\";s:8:\"\u0000*\u0000coden\";s:0:\"\";s:8:\"\u0000*\u0000genre\";s:7:\"article\";s:7:\"\u0000*\u0000part\";s:0:\"\";s:9:\"\u0000*\u0000btitle\";s:0:\"\";s:8:\"\u0000*\u0000title\";s:138:\"BaTiO3: Energy, geometrical and electronic structure, relationship between optical constant and density from first-principles calculations\";s:8:\"\u0000*\u0000place\";s:6:\"Oxford\";s:6:\"\u0000*\u0000pub\";s:8:\"Elsevier\";s:10:\"\u0000*\u0000edition\";s:0:\"\";s:9:\"\u0000*\u0000tpages\";s:1:\"9\";s:9:\"\u0000*\u0000series\";s:0:\"\";s:8:\"\u0000*\u0000proxy\";s:30:\"http:\/\/proxyout.inist.fr:8080\/\";s:12:\"\u0000*\u0000integrite\";b:1;}"
Accès par arXiv
