Rotational profiles of molecular absorption bands in astrophysically relevant conditions: ab-initio approach
- Author
- MALLOCI, Giuliano1 2 ; MULAS, Giacomo1 ; CAPPELLINI, Giancarlo2 3 ; SATTA, Guido2 3 ; PORCEDDU, Ignazio1 ; BENVENUTI, Piero2 4
[1] INAF-Osservatorio Astronomico di Cagliari, Strada n.54, Loc. Poggio dei Pini, 09012 Capoterra (CA), Italy
[2] Dipartimento di Fisica Universitá di Cagliari, S.P. Monserrato-Sestu km 0. 700, 09042 Monserrato (CA), Italy
[3] Istituto Nazionale di Fisica della Materia (INFM), Corso Perrone 24, 16152 Genova, Italy
[4] Space Telescope-European Coordinating Facility, European Southern Observatory, Karl-Schwarzschild - Strasse 2, 85748 Garching bei Munchen, Germany - Conference title
- Selected papers of the Twelfth International Workshop on Computational Materials Science, Villasimius, Sardinia, Italy, 23-29 September, 2002 (CMS 2002)
- Conference name
- International Workshop on Computational Materials Science (12 ; Villasimius, Sardinia 2002-09-23)
- Author (monograph)
- FIORENTINI, Vincenzo (Editor)1 ; MELONI, Franco (Editor)1 ; RUGGERONE, Paolo (Editor)1
[1] INFM-Dipartimento di Fisica, Universita' di Cagliari, S.P. Monserrato-Sestu Km 0.700, 09042 Monserrato, Italy - Source
Computational materials science. 2004, Vol 30, Num 1-2, pp 92-97, 6 p ; ref : 19 ref
- ISSN
- 0927-0256
- Scientific domain
- Condensed state physics
- Publisher
- Elsevier Science, Amsterdam
- Publication country
- Netherlands
- Document type
- Conference Paper
- Language
- English
- Keyword (fr)
- Calcul ab initio Mode vibration Méthode fonctionnelle densité Simulation numérique 63
- Keyword (en)
- Ab initio calculations Vibrational modes Density functional method Digital simulation
- Classification
- Pascal
- 001 Exact sciences and technology / 001B Physics / 001B60 Condensed matter: structure, mechanical and thermal properties / 001B60C Lattice dynamics
- Discipline
- Physics of condensed state : structure, mechanical and thermal properties
- Origin
- Inist-CNRS
- Database
- PASCAL
- INIST identifier
- 15724924
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
Access to the document
Install on your browser
DOI
10.1016/j.commatsci.2004.01.014 
https://dx.doi.org/10.1016/j.commatsci.2004.01.014
"O:13:\"PanistOpenUrl\":36:{s:10:\"\u0000*\u0000openUrl\";N;s:6:\"\u0000*\u0000idc\";N;s:6:\"\u0000*\u0000fmt\";s:10:\"proceeding\";s:6:\"\u0000*\u0000doi\";s:31:\"10.1016\/j.commatsci.2004.01.014\";s:6:\"\u0000*\u0000pii\";s:0:\"\";s:7:\"\u0000*\u0000pmid\";s:0:\"\";s:9:\"\u0000*\u0000atitle\";s:108:\"Rotational profiles of molecular absorption bands in astrophysically relevant conditions: ab-initio approach\";s:9:\"\u0000*\u0000jtitle\";s:31:\"Computational materials science\";s:9:\"\u0000*\u0000stitle\";s:18:\"Comput. mater. sci\";s:7:\"\u0000*\u0000date\";s:4:\"2004\";s:9:\"\u0000*\u0000volume\";s:2:\"30\";s:8:\"\u0000*\u0000issue\";s:3:\"1-2\";s:8:\"\u0000*\u0000spage\";s:2:\"92\";s:8:\"\u0000*\u0000epage\";s:2:\"97\";s:8:\"\u0000*\u0000pages\";s:0:\"\";s:7:\"\u0000*\u0000issn\";s:9:\"0927-0256\";s:8:\"\u0000*\u0000eissn\";s:0:\"\";s:9:\"\u0000*\u0000aulast\";s:7:\"MALLOCI\";s:10:\"\u0000*\u0000aufirst\";s:8:\"Giuliano\";s:9:\"\u0000*\u0000auinit\";s:0:\"\";s:10:\"\u0000*\u0000auinitm\";s:0:\"\";s:5:\"\u0000*\u0000au\";a:5:{i:0;s:14:\"MULAS, Giacomo\";i:1;s:21:\"CAPPELLINI, Giancarlo\";i:2;s:12:\"SATTA, Guido\";i:3;s:17:\"PORCEDDU, Ignazio\";i:4;s:16:\"BENVENUTI, Piero\";}s:9:\"\u0000*\u0000aucorp\";s:0:\"\";s:7:\"\u0000*\u0000isbn\";s:0:\"\";s:8:\"\u0000*\u0000coden\";s:0:\"\";s:8:\"\u0000*\u0000genre\";s:10:\"proceeding\";s:7:\"\u0000*\u0000part\";s:0:\"\";s:9:\"\u0000*\u0000btitle\";s:152:\"Selected papers of the Twelfth International Workshop on Computational Materials Science, Villasimius, Sardinia, Italy, 23-29 September, 2002 (CMS 2002)\";s:8:\"\u0000*\u0000title\";s:108:\"Rotational profiles of molecular absorption bands in astrophysically relevant conditions: ab-initio approach\";s:8:\"\u0000*\u0000place\";s:9:\"Amsterdam\";s:6:\"\u0000*\u0000pub\";s:16:\"Elsevier Science\";s:10:\"\u0000*\u0000edition\";s:0:\"\";s:9:\"\u0000*\u0000tpages\";s:1:\"6\";s:9:\"\u0000*\u0000series\";s:0:\"\";s:8:\"\u0000*\u0000proxy\";s:30:\"http:\/\/proxyout.inist.fr:8080\/\";s:12:\"\u0000*\u0000integrite\";b:1;}"
Panist access
"O:12:\"IstexOpenUrl\":35:{s:10:\"\u0000*\u0000openUrl\";N;s:6:\"\u0000*\u0000fmt\";s:10:\"proceeding\";s:6:\"\u0000*\u0000doi\";s:31:\"10.1016\/j.commatsci.2004.01.014\";s:6:\"\u0000*\u0000pii\";s:0:\"\";s:7:\"\u0000*\u0000pmid\";s:0:\"\";s:9:\"\u0000*\u0000atitle\";s:108:\"Rotational profiles of molecular absorption bands in astrophysically relevant conditions: ab-initio approach\";s:9:\"\u0000*\u0000jtitle\";s:31:\"Computational materials science\";s:9:\"\u0000*\u0000stitle\";s:18:\"Comput. mater. sci\";s:7:\"\u0000*\u0000date\";s:4:\"2004\";s:9:\"\u0000*\u0000volume\";s:2:\"30\";s:8:\"\u0000*\u0000issue\";s:3:\"1-2\";s:8:\"\u0000*\u0000spage\";s:2:\"92\";s:8:\"\u0000*\u0000epage\";s:2:\"97\";s:8:\"\u0000*\u0000pages\";s:0:\"\";s:7:\"\u0000*\u0000issn\";s:9:\"0927-0256\";s:8:\"\u0000*\u0000eissn\";s:0:\"\";s:9:\"\u0000*\u0000aulast\";s:7:\"MALLOCI\";s:10:\"\u0000*\u0000aufirst\";s:8:\"Giuliano\";s:9:\"\u0000*\u0000auinit\";s:0:\"\";s:10:\"\u0000*\u0000auinitm\";s:0:\"\";s:5:\"\u0000*\u0000au\";a:5:{i:0;s:14:\"MULAS, Giacomo\";i:1;s:21:\"CAPPELLINI, Giancarlo\";i:2;s:12:\"SATTA, Guido\";i:3;s:17:\"PORCEDDU, Ignazio\";i:4;s:16:\"BENVENUTI, Piero\";}s:9:\"\u0000*\u0000aucorp\";s:0:\"\";s:7:\"\u0000*\u0000isbn\";s:0:\"\";s:8:\"\u0000*\u0000coden\";s:0:\"\";s:8:\"\u0000*\u0000genre\";s:10:\"proceeding\";s:7:\"\u0000*\u0000part\";s:0:\"\";s:9:\"\u0000*\u0000btitle\";s:152:\"Selected papers of the Twelfth International Workshop on Computational Materials Science, Villasimius, Sardinia, Italy, 23-29 September, 2002 (CMS 2002)\";s:8:\"\u0000*\u0000title\";s:108:\"Rotational profiles of molecular absorption bands in astrophysically relevant conditions: ab-initio approach\";s:8:\"\u0000*\u0000place\";s:9:\"Amsterdam\";s:6:\"\u0000*\u0000pub\";s:16:\"Elsevier Science\";s:10:\"\u0000*\u0000edition\";s:0:\"\";s:9:\"\u0000*\u0000tpages\";s:1:\"6\";s:9:\"\u0000*\u0000series\";s:0:\"\";s:8:\"\u0000*\u0000proxy\";s:30:\"http:\/\/proxyout.inist.fr:8080\/\";s:12:\"\u0000*\u0000integrite\";b:1;}"
Istex access
"O:16:\"UnpaywallOpenUrl\":35:{s:8:\"\u0000*\u0000email\";s:27:\"assistance-portail@inist.fr\";s:6:\"\u0000*\u0000fmt\";N;s:6:\"\u0000*\u0000doi\";s:31:\"10.1016\/j.commatsci.2004.01.014\";s:6:\"\u0000*\u0000pii\";N;s:7:\"\u0000*\u0000pmid\";N;s:9:\"\u0000*\u0000atitle\";N;s:9:\"\u0000*\u0000jtitle\";N;s:9:\"\u0000*\u0000stitle\";N;s:7:\"\u0000*\u0000date\";N;s:9:\"\u0000*\u0000volume\";N;s:8:\"\u0000*\u0000issue\";N;s:8:\"\u0000*\u0000spage\";N;s:8:\"\u0000*\u0000epage\";N;s:8:\"\u0000*\u0000pages\";N;s:7:\"\u0000*\u0000issn\";N;s:8:\"\u0000*\u0000eissn\";N;s:9:\"\u0000*\u0000aulast\";N;s:10:\"\u0000*\u0000aufirst\";N;s:9:\"\u0000*\u0000auinit\";N;s:10:\"\u0000*\u0000auinitm\";N;s:5:\"\u0000*\u0000au\";N;s:9:\"\u0000*\u0000aucorp\";N;s:7:\"\u0000*\u0000isbn\";N;s:8:\"\u0000*\u0000coden\";N;s:8:\"\u0000*\u0000genre\";N;s:7:\"\u0000*\u0000part\";N;s:9:\"\u0000*\u0000btitle\";N;s:8:\"\u0000*\u0000title\";N;s:8:\"\u0000*\u0000place\";N;s:6:\"\u0000*\u0000pub\";N;s:10:\"\u0000*\u0000edition\";N;s:9:\"\u0000*\u0000tpages\";N;s:9:\"\u0000*\u0000series\";N;s:8:\"\u0000*\u0000proxy\";s:30:\"http:\/\/proxyout.inist.fr:8080\/\";s:12:\"\u0000*\u0000integrite\";N;}"
Unpaywall access
"O:16:\"EuropePMCOpenUrl\":35:{s:10:\"\u0000*\u0000openUrl\";N;s:6:\"\u0000*\u0000fmt\";s:10:\"proceeding\";s:6:\"\u0000*\u0000doi\";s:31:\"10.1016\/j.commatsci.2004.01.014\";s:6:\"\u0000*\u0000pii\";s:0:\"\";s:7:\"\u0000*\u0000pmid\";s:0:\"\";s:9:\"\u0000*\u0000atitle\";s:108:\"Rotational profiles of molecular absorption bands in astrophysically relevant conditions: ab-initio approach\";s:9:\"\u0000*\u0000jtitle\";s:31:\"Computational materials science\";s:9:\"\u0000*\u0000stitle\";s:18:\"Comput. mater. sci\";s:7:\"\u0000*\u0000date\";s:4:\"2004\";s:9:\"\u0000*\u0000volume\";s:2:\"30\";s:8:\"\u0000*\u0000issue\";s:3:\"1-2\";s:8:\"\u0000*\u0000spage\";s:2:\"92\";s:8:\"\u0000*\u0000epage\";s:2:\"97\";s:8:\"\u0000*\u0000pages\";s:0:\"\";s:7:\"\u0000*\u0000issn\";s:9:\"0927-0256\";s:8:\"\u0000*\u0000eissn\";s:0:\"\";s:9:\"\u0000*\u0000aulast\";s:7:\"MALLOCI\";s:10:\"\u0000*\u0000aufirst\";s:8:\"Giuliano\";s:9:\"\u0000*\u0000auinit\";s:0:\"\";s:10:\"\u0000*\u0000auinitm\";s:0:\"\";s:5:\"\u0000*\u0000au\";a:5:{i:0;s:14:\"MULAS, Giacomo\";i:1;s:21:\"CAPPELLINI, Giancarlo\";i:2;s:12:\"SATTA, Guido\";i:3;s:17:\"PORCEDDU, Ignazio\";i:4;s:16:\"BENVENUTI, Piero\";}s:9:\"\u0000*\u0000aucorp\";s:0:\"\";s:7:\"\u0000*\u0000isbn\";s:0:\"\";s:8:\"\u0000*\u0000coden\";s:0:\"\";s:8:\"\u0000*\u0000genre\";s:10:\"proceeding\";s:7:\"\u0000*\u0000part\";s:0:\"\";s:9:\"\u0000*\u0000btitle\";s:152:\"Selected papers of the Twelfth International Workshop on Computational Materials Science, Villasimius, Sardinia, Italy, 23-29 September, 2002 (CMS 2002)\";s:8:\"\u0000*\u0000title\";s:108:\"Rotational profiles of molecular absorption bands in astrophysically relevant conditions: ab-initio approach\";s:8:\"\u0000*\u0000place\";s:9:\"Amsterdam\";s:6:\"\u0000*\u0000pub\";s:16:\"Elsevier Science\";s:10:\"\u0000*\u0000edition\";s:0:\"\";s:9:\"\u0000*\u0000tpages\";s:1:\"6\";s:9:\"\u0000*\u0000series\";s:0:\"\";s:8:\"\u0000*\u0000proxy\";s:30:\"http:\/\/proxyout.inist.fr:8080\/\";s:12:\"\u0000*\u0000integrite\";b:1;}"
Europe PubMed Central access
"O:11:\"BaseOpenUrl\":35:{s:10:\"\u0000*\u0000openUrl\";N;s:6:\"\u0000*\u0000fmt\";s:10:\"proceeding\";s:6:\"\u0000*\u0000doi\";s:31:\"10.1016\/j.commatsci.2004.01.014\";s:6:\"\u0000*\u0000pii\";s:0:\"\";s:7:\"\u0000*\u0000pmid\";s:0:\"\";s:9:\"\u0000*\u0000atitle\";s:108:\"Rotational profiles of molecular absorption bands in astrophysically relevant conditions: ab-initio approach\";s:9:\"\u0000*\u0000jtitle\";s:31:\"Computational materials science\";s:9:\"\u0000*\u0000stitle\";s:18:\"Comput. mater. sci\";s:7:\"\u0000*\u0000date\";s:4:\"2004\";s:9:\"\u0000*\u0000volume\";s:2:\"30\";s:8:\"\u0000*\u0000issue\";s:3:\"1-2\";s:8:\"\u0000*\u0000spage\";s:2:\"92\";s:8:\"\u0000*\u0000epage\";s:2:\"97\";s:8:\"\u0000*\u0000pages\";s:0:\"\";s:7:\"\u0000*\u0000issn\";s:9:\"0927-0256\";s:8:\"\u0000*\u0000eissn\";s:0:\"\";s:9:\"\u0000*\u0000aulast\";s:7:\"MALLOCI\";s:10:\"\u0000*\u0000aufirst\";s:8:\"Giuliano\";s:9:\"\u0000*\u0000auinit\";s:0:\"\";s:10:\"\u0000*\u0000auinitm\";s:0:\"\";s:5:\"\u0000*\u0000au\";a:5:{i:0;s:14:\"MULAS, Giacomo\";i:1;s:21:\"CAPPELLINI, Giancarlo\";i:2;s:12:\"SATTA, Guido\";i:3;s:17:\"PORCEDDU, Ignazio\";i:4;s:16:\"BENVENUTI, Piero\";}s:9:\"\u0000*\u0000aucorp\";s:0:\"\";s:7:\"\u0000*\u0000isbn\";s:0:\"\";s:8:\"\u0000*\u0000coden\";s:0:\"\";s:8:\"\u0000*\u0000genre\";s:10:\"proceeding\";s:7:\"\u0000*\u0000part\";s:0:\"\";s:9:\"\u0000*\u0000btitle\";s:152:\"Selected papers of the Twelfth International Workshop on Computational Materials Science, Villasimius, Sardinia, Italy, 23-29 September, 2002 (CMS 2002)\";s:8:\"\u0000*\u0000title\";s:108:\"Rotational profiles of molecular absorption bands in astrophysically relevant conditions: ab-initio approach\";s:8:\"\u0000*\u0000place\";s:9:\"Amsterdam\";s:6:\"\u0000*\u0000pub\";s:16:\"Elsevier Science\";s:10:\"\u0000*\u0000edition\";s:0:\"\";s:9:\"\u0000*\u0000tpages\";s:1:\"6\";s:9:\"\u0000*\u0000series\";s:0:\"\";s:8:\"\u0000*\u0000proxy\";s:30:\"http:\/\/proxyout.inist.fr:8080\/\";s:12:\"\u0000*\u0000integrite\";b:1;}"
Base Search access
"O:12:\"ArXivOpenUrl\":35:{s:10:\"\u0000*\u0000openUrl\";N;s:6:\"\u0000*\u0000fmt\";s:10:\"proceeding\";s:6:\"\u0000*\u0000doi\";s:31:\"10.1016\/j.commatsci.2004.01.014\";s:6:\"\u0000*\u0000pii\";s:0:\"\";s:7:\"\u0000*\u0000pmid\";s:0:\"\";s:9:\"\u0000*\u0000atitle\";s:108:\"Rotational profiles of molecular absorption bands in astrophysically relevant conditions: ab-initio approach\";s:9:\"\u0000*\u0000jtitle\";s:31:\"Computational materials science\";s:9:\"\u0000*\u0000stitle\";s:18:\"Comput. mater. sci\";s:7:\"\u0000*\u0000date\";s:4:\"2004\";s:9:\"\u0000*\u0000volume\";s:2:\"30\";s:8:\"\u0000*\u0000issue\";s:3:\"1-2\";s:8:\"\u0000*\u0000spage\";s:2:\"92\";s:8:\"\u0000*\u0000epage\";s:2:\"97\";s:8:\"\u0000*\u0000pages\";s:0:\"\";s:7:\"\u0000*\u0000issn\";s:9:\"0927-0256\";s:8:\"\u0000*\u0000eissn\";s:0:\"\";s:9:\"\u0000*\u0000aulast\";s:7:\"MALLOCI\";s:10:\"\u0000*\u0000aufirst\";s:8:\"Giuliano\";s:9:\"\u0000*\u0000auinit\";s:0:\"\";s:10:\"\u0000*\u0000auinitm\";s:0:\"\";s:5:\"\u0000*\u0000au\";a:5:{i:0;s:14:\"MULAS, Giacomo\";i:1;s:21:\"CAPPELLINI, Giancarlo\";i:2;s:12:\"SATTA, Guido\";i:3;s:17:\"PORCEDDU, Ignazio\";i:4;s:16:\"BENVENUTI, Piero\";}s:9:\"\u0000*\u0000aucorp\";s:0:\"\";s:7:\"\u0000*\u0000isbn\";s:0:\"\";s:8:\"\u0000*\u0000coden\";s:0:\"\";s:8:\"\u0000*\u0000genre\";s:10:\"proceeding\";s:7:\"\u0000*\u0000part\";s:0:\"\";s:9:\"\u0000*\u0000btitle\";s:152:\"Selected papers of the Twelfth International Workshop on Computational Materials Science, Villasimius, Sardinia, Italy, 23-29 September, 2002 (CMS 2002)\";s:8:\"\u0000*\u0000title\";s:108:\"Rotational profiles of molecular absorption bands in astrophysically relevant conditions: ab-initio approach\";s:8:\"\u0000*\u0000place\";s:9:\"Amsterdam\";s:6:\"\u0000*\u0000pub\";s:16:\"Elsevier Science\";s:10:\"\u0000*\u0000edition\";s:0:\"\";s:9:\"\u0000*\u0000tpages\";s:1:\"6\";s:9:\"\u0000*\u0000series\";s:0:\"\";s:8:\"\u0000*\u0000proxy\";s:30:\"http:\/\/proxyout.inist.fr:8080\/\";s:12:\"\u0000*\u0000integrite\";b:1;}"
arXiv access
