Electronic structure calculations for solids and molecules: theory and computational methods
Gespeichert in:
| 1. Verfasser: | |
|---|---|
| Format: | Buch |
| Sprache: | English |
| Veröffentlicht: |
Cambridge
Cambridge Univ. Press
2006
|
| Ausgabe: | 1. publ. |
| Schlagworte: | |
| Online-Zugang: | Inhaltsverzeichnis |
| Beschreibung: | XXII, 348 S. graph. Darst. |
| ISBN: | 0521815916 9780521815918 |
Internformat
MARC
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| 100 | 1 | |a Kohanoff, Jorge José |e Verfasser |0 (DE-588)142086428 |4 aut | |
| 245 | 1 | 0 | |a Electronic structure calculations for solids and molecules |b theory and computational methods |c Jorge Kohanoff |
| 250 | |a 1. publ. | ||
| 264 | 1 | |a Cambridge |b Cambridge Univ. Press |c 2006 | |
| 300 | |a XXII, 348 S. |b graph. Darst. | ||
| 336 | |b txt |2 rdacontent | ||
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| 650 | 4 | |a Festkörper - Elektronenstruktur | |
| 650 | 4 | |a Molekül - Elektronenstruktur | |
| 650 | 4 | |a Condensed matter |x Computer simulation | |
| 650 | 4 | |a Density functionals | |
| 650 | 4 | |a Hartree-Fock approximation | |
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Datensatz im Suchindex
| _version_ | 1804135558455230464 |
|---|---|
| adam_text | Contents
Preface page
List of symbols
List of acronyms
Part I Theory
1
1.1
1.2
2
2.1
2.2
2.3
3
3.1
3.2
4
4.1
4.2
4.3
4.4
5
performances
5.1
5.2
5.3
vii
viii Contents
5.4 Hybrid HF-KS
5.5
5.6
5.7
5.8
5.9
5.10
Part II Computational methods
6
6.1
6.2
conditions
7
7.1
7.2
7.3
7.4
7.5
8
8.1
8.2
8.3
8.4
8.5
8.6
9
9.1
9.2
9.3
9.4
9.5
10
10.1
10.2
10.3
10.4
Contents ix
10.5
10.6
10.7
11
11.1
11.2
11.3
12
12.1
12.2
12.3
12.4
12.5
12.6
Index
|
| adam_txt |
Contents
Preface page
List of symbols
List of acronyms
Part I Theory
1
1.1
1.2
2
2.1
2.2
2.3
3
3.1
3.2
4
4.1
4.2
4.3
4.4
5
performances
5.1
5.2
5.3
vii
viii Contents
5.4 Hybrid HF-KS
5.5
5.6
5.7
5.8
5.9
5.10
Part II Computational methods
6
6.1
6.2
conditions
7
7.1
7.2
7.3
7.4
7.5
8
8.1
8.2
8.3
8.4
8.5
8.6
9
9.1
9.2
9.3
9.4
9.5
10
10.1
10.2
10.3
10.4
Contents ix
10.5
10.6
10.7
11
11.1
11.2
11.3
12
12.1
12.2
12.3
12.4
12.5
12.6
Index |
| any_adam_object | 1 |
| any_adam_object_boolean | 1 |
| author | Kohanoff, Jorge José |
| author_GND | (DE-588)142086428 |
| author_facet | Kohanoff, Jorge José |
| author_role | aut |
| author_sort | Kohanoff, Jorge José |
| author_variant | j j k jj jjk |
| building | Verbundindex |
| bvnumber | BV021718134 |
| callnumber-first | Q - Science |
| callnumber-label | QD462 |
| callnumber-raw | QD462.6.D45 |
| callnumber-search | QD462.6.D45 |
| callnumber-sort | QD 3462.6 D45 |
| callnumber-subject | QD - Chemistry |
| classification_rvk | UP 3600 VE 5650 |
| classification_tum | CHE 150f PHY 602f PHY 501f |
| ctrlnum | (OCoLC)254698805 (DE-599)BVBBV021718134 |
| dewey-full | 541.22 |
| dewey-hundreds | 500 - Natural sciences and mathematics |
| dewey-ones | 541 - Physical chemistry |
| dewey-raw | 541.22 |
| dewey-search | 541.22 |
| dewey-sort | 3541.22 |
| dewey-tens | 540 - Chemistry and allied sciences |
| discipline | Chemie / Pharmazie Physik Chemie |
| discipline_str_mv | Chemie / Pharmazie Physik Chemie |
| edition | 1. publ. |
| format | Book |
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| id | DE-604.BV021718134 |
| illustrated | Illustrated |
| index_date | 2024-07-02T15:22:33Z |
| indexdate | 2024-07-09T20:42:25Z |
| institution | BVB |
| isbn | 0521815916 9780521815918 |
| language | English |
| oai_aleph_id | oai:aleph.bib-bvb.de:BVB01-014931844 |
| oclc_num | 254698805 |
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| owner_facet | DE-91G DE-BY-TUM DE-355 DE-BY-UBR DE-29T DE-11 DE-384 |
| physical | XXII, 348 S. graph. Darst. |
| publishDate | 2006 |
| publishDateSearch | 2006 |
| publishDateSort | 2006 |
| publisher | Cambridge Univ. Press |
| record_format | marc |
| spelling | Kohanoff, Jorge José Verfasser (DE-588)142086428 aut Electronic structure calculations for solids and molecules theory and computational methods Jorge Kohanoff 1. publ. Cambridge Cambridge Univ. Press 2006 XXII, 348 S. graph. Darst. txt rdacontent n rdamedia nc rdacarrier Festkörper - Elektronenstruktur Molekül - Elektronenstruktur Condensed matter Computer simulation Density functionals Hartree-Fock approximation Elektronenstruktur (DE-588)4129531-6 gnd rswk-swf Hartree-Fock-Methode (DE-588)4137025-9 gnd rswk-swf Numerisches Verfahren (DE-588)4128130-5 gnd rswk-swf Dichtefunktionalformalismus (DE-588)4258514-4 gnd rswk-swf Festkörper (DE-588)4016918-2 gnd rswk-swf Elektronenstruktur (DE-588)4129531-6 s Hartree-Fock-Methode (DE-588)4137025-9 s DE-604 Dichtefunktionalformalismus (DE-588)4258514-4 s Festkörper (DE-588)4016918-2 s Numerisches Verfahren (DE-588)4128130-5 s Digitalisierung UB Regensburg application/pdf http://bvbr.bib-bvb.de:8991/F?func=service&doc_library=BVB01&local_base=BVB01&doc_number=014931844&sequence=000002&line_number=0001&func_code=DB_RECORDS&service_type=MEDIA Inhaltsverzeichnis |
| spellingShingle | Kohanoff, Jorge José Electronic structure calculations for solids and molecules theory and computational methods Festkörper - Elektronenstruktur Molekül - Elektronenstruktur Condensed matter Computer simulation Density functionals Hartree-Fock approximation Elektronenstruktur (DE-588)4129531-6 gnd Hartree-Fock-Methode (DE-588)4137025-9 gnd Numerisches Verfahren (DE-588)4128130-5 gnd Dichtefunktionalformalismus (DE-588)4258514-4 gnd Festkörper (DE-588)4016918-2 gnd |
| subject_GND | (DE-588)4129531-6 (DE-588)4137025-9 (DE-588)4128130-5 (DE-588)4258514-4 (DE-588)4016918-2 |
| title | Electronic structure calculations for solids and molecules theory and computational methods |
| title_auth | Electronic structure calculations for solids and molecules theory and computational methods |
| title_exact_search | Electronic structure calculations for solids and molecules theory and computational methods |
| title_exact_search_txtP | Electronic structure calculations for solids and molecules theory and computational methods |
| title_full | Electronic structure calculations for solids and molecules theory and computational methods Jorge Kohanoff |
| title_fullStr | Electronic structure calculations for solids and molecules theory and computational methods Jorge Kohanoff |
| title_full_unstemmed | Electronic structure calculations for solids and molecules theory and computational methods Jorge Kohanoff |
| title_short | Electronic structure calculations for solids and molecules |
| title_sort | electronic structure calculations for solids and molecules theory and computational methods |
| title_sub | theory and computational methods |
| topic | Festkörper - Elektronenstruktur Molekül - Elektronenstruktur Condensed matter Computer simulation Density functionals Hartree-Fock approximation Elektronenstruktur (DE-588)4129531-6 gnd Hartree-Fock-Methode (DE-588)4137025-9 gnd Numerisches Verfahren (DE-588)4128130-5 gnd Dichtefunktionalformalismus (DE-588)4258514-4 gnd Festkörper (DE-588)4016918-2 gnd |
| topic_facet | Festkörper - Elektronenstruktur Molekül - Elektronenstruktur Condensed matter Computer simulation Density functionals Hartree-Fock approximation Elektronenstruktur Hartree-Fock-Methode Numerisches Verfahren Dichtefunktionalformalismus Festkörper |
| url | http://bvbr.bib-bvb.de:8991/F?func=service&doc_library=BVB01&local_base=BVB01&doc_number=014931844&sequence=000002&line_number=0001&func_code=DB_RECORDS&service_type=MEDIA |
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