A specialist periodical report : Chemical modelling / Editors: Hilke Bahmann (Wuppertal University, Germany), Jean Christophe Tremblay (Université de Lorraine, France) ; Authors Brigitta Bachmair (University of Vienna, Austria); Annika Bande (Helmholtz-Zentrum Berlin für Materialien und Energie GmbH, Germany), Thibaud Etienne (Université de Lorraine), France Anthony Ferté (Nantes Université, France) [und weitere]
Chemical modelling covers a wide range of disciplines, and this book is the first stop for any chemist, materials scientist, biochemist, or molecular physicist wishing to acquaint themselves with major developments in the applications and theory of chemical modelling. Containing both comprehensive and critical reviews, it is a convenient reference to the current literature. Coverage includes, but is not limited to, considerations towards rigorous foundations for the natural-orbital representation of molecular electronic transitions, quantum and classical embedding schemes for optical properties, machine learning for excited states, ultrafast and wave function-based electron dynamics, and attosecond chemistry.
| Medienart: |
E-Book |
|---|
| Erscheinungsjahr: |
[2023] © 2023 |
|---|---|
| Erschienen: |
Cambridge, UK: Royal Society of Chemistry ; 2023 © 2023 |
| Reihe: |
Chemical Modelling - Volume 17 |
|---|
| Sprache: |
Englisch |
|---|
| Beteiligte Personen: |
Bahmann, Hilke [HerausgeberIn] |
|---|
| Links: |
dx.doi.org [lizenzpflichtig] |
|---|
| ISBN: |
|---|
| BKL: | |
|---|---|
| Themen: |
Angeregter Zustand |
| Umfang: |
1 Online-Ressource |
|---|
| Förderinstitution / Projekttitel: |
|
|---|
| PPN (Katalog-ID): |
1830483242 |
|---|
| LEADER | 01000cam a2200265 4500 | ||
|---|---|---|---|
| 001 | 1830483242 | ||
| 003 | DE-627 | ||
| 005 | 20231127083138.0 | ||
| 007 | cr uuu---uuuuu | ||
| 008 | 230106s2023 xxk|||||o 00| ||eng c | ||
| 020 | |a 9781839169342 |9 978-1-83916-934-2 | ||
| 020 | |a 9781839169359 |9 978-1-83916-935-9 | ||
| 035 | |a (DE-627)1830483242 | ||
| 035 | |a (DE-599)KXP1830483242 | ||
| 040 | |a DE-627 |b ger |c DE-627 |e rda | ||
| 041 | |a eng | ||
| 044 | |c XA-GB | ||
| 084 | |a 35.11 |2 bkl | ||
| 084 | |a 35.06 |2 bkl | ||
| 245 | 1 | 2 | |a A specialist periodical report |b Chemical modelling |c Editors: Hilke Bahmann (Wuppertal University, Germany), Jean Christophe Tremblay (Université de Lorraine, France) ; Authors Brigitta Bachmair (University of Vienna, Austria); Annika Bande (Helmholtz-Zentrum Berlin für Materialien und Energie GmbH, Germany), Thibaud Etienne (Université de Lorraine), France Anthony Ferté (Nantes Université, France) [und weitere] |
| 264 | 1 | |a Cambridge, UK |b Royal Society of Chemistry |c [2023] | |
| 264 | 4 | |c © 2023 | |
| 300 | |a 1 Online-Ressource | ||
| 336 | |a Text |b txt |2 rdacontent | ||
| 337 | |a Computermedien |b c |2 rdamedia | ||
| 338 | |a Online-Ressource |b cr |2 rdacarrier | ||
| 490 | 1 | |a Chemical Modelling |v Volume 17 | |
| 490 | 1 | |a Specialist periodical reports | |
| 520 | |a Chemical modelling covers a wide range of disciplines, and this book is the first stop for any chemist, materials scientist, biochemist, or molecular physicist wishing to acquaint themselves with major developments in the applications and theory of chemical modelling. Containing both comprehensive and critical reviews, it is a convenient reference to the current literature. Coverage includes, but is not limited to, considerations towards rigorous foundations for the natural-orbital representation of molecular electronic transitions, quantum and classical embedding schemes for optical properties, machine learning for excited states, ultrafast and wave function-based electron dynamics, and attosecond chemistry | ||
| 650 | 0 | |a Chemical models |x Mathematics | |
| 650 | 0 | |a Molecules |x Computer simulation | |
| 689 | 0 | 0 | |D s |0 (DE-588)4170370-4 |0 (DE-627)104297026 |0 (DE-576)209929804 |a Molekulardynamik |2 gnd |
| 689 | 0 | 1 | |D s |0 (DE-588)4142423-2 |0 (DE-627)105613282 |0 (DE-576)209718668 |a Angeregter Zustand |2 gnd |
| 689 | 0 | 2 | |D s |0 (DE-588)4463785-8 |0 (DE-627)231347685 |0 (DE-576)21270057X |a Elektronische Anregung |2 gnd |
| 689 | 0 | |5 (DE-627) | |
| 689 | 1 | 0 | |D s |0 (DE-588)4193754-5 |0 (DE-627)105224782 |0 (DE-576)21008944X |a Maschinelles Lernen |2 gnd |
| 689 | 1 | |5 (DE-627) | |
| 700 | 1 | |a Bahmann, Hilke |e herausgeberin |0 (DE-588)144003546 |0 (DE-627)656808209 |0 (DE-576)340532556 |4 edt | |
| 700 | 1 | |a Tremblay, Jean Christophe |e herausgeberin |4 edt | |
| 700 | 1 | |a Bachmair, Brigitta |e verfasserin |4 aut | |
| 700 | 1 | |a Bande, Annika |d 1979- |e verfasserin |0 (DE-588)133913368 |0 (DE-627)558728162 |0 (DE-576)30018865X |4 aut | |
| 700 | 1 | |a Etienne, Thibaud |e verfasserin |4 aut | |
| 700 | 1 | |a Ferté, Anthony |e verfasserin |4 aut | |
| 776 | 1 | |z 9781839167416 | |
| 830 | 0 | |a Chemical modelling |v Volume 17 |9 17 |w (DE-627)363736085 |w (DE-576)304138916 |w (DE-600)2103059-5 |x 1472-0973 |7 ns | |
| 856 | 4 | 0 | |u http://dx.doi.org/10.1039/9781839169342 |x Resolving-System |z lizenzpflichtig |
| 856 | 4 | 0 | |u http://pubs.rsc.org/en/content/ebook/9781839169342 |x Verlag |z lizenzpflichtig |
| 856 | 4 | 2 | |u http://www.gbv.de/dms/bowker/toc/9781839167416.pdf |v 2023-02-28 |x Aggregator |3 Inhaltsverzeichnis |
| 912 | |a ZDB-1-RSEK |b 2022 | ||
| 912 | |a GBV_ILN_62 | ||
| 912 | |a ISIL_DE-28 | ||
| 912 | |a SYSFLAG_1 | ||
| 912 | |a GBV_KXP | ||
| 912 | |a SSG-OLC-PHA | ||
| 912 | |a GBV_ILN_70 | ||
| 912 | |a ISIL_DE-89 | ||
| 912 | |a GBV_ILN_120 | ||
| 912 | |a ISIL_DE-715 | ||
| 912 | |a GBV_ILN_2001 | ||
| 912 | |a ISIL_DE-21 | ||
| 912 | |a GBV_ILN_2003 | ||
| 912 | |a ISIL_DE-25 | ||
| 912 | |a GBV_ILN_2005 | ||
| 912 | |a ISIL_DE-291-415 | ||
| 912 | |a GBV_ILN_2014 | ||
| 912 | |a ISIL_DE-90 | ||
| 912 | |a GBV_ILN_2027 | ||
| 912 | |a ISIL_DE-105 | ||
| 936 | b | k | |a 35.11 |j Quantenchemie |j chemische Bindung |0 (DE-627)106417428 |
| 936 | b | k | |a 35.06 |j Computeranwendungen |x Chemie |0 (DE-627)106417231 |
| 951 | |a BO | ||
| 980 | |2 62 |1 01 |x 0028 |b 4244936440 |h OLR-RSEK |k Vervielfältigungen (z.B. Kopien, Downloads) sind nur von einzelnen Kapiteln oder Seiten und nur zum eigenen wissenschaftlichen Gebrauch erlaubt. Die Weitergabe an Dritte sowie systematisches Downloaden sind untersagt. |y z |z 08-01-23 | ||
| 980 | |2 70 |1 01 |x 0089 |b 4244704396 |h OLR-AL-RSE |k Campusweiter Zugriff (Universität Hannover).- Vervielfältigungen (z.B. Kopien, Downloads) sind nur von einzelnen Kapiteln oder Seiten und nur zum eigenen wissenschaftlichen Gebrauch erlaubt. Keine Weitergabe an Dritte. Kein systematisches Downloaden durch Robots. |y z |z 06-01-23 | ||
| 980 | |2 120 |1 01 |x 0715 |b 4248199971 |c 00 |f --%%-- |d --%%-- |e g |j --%%-- |h alma |y z |z 15-01-23 | ||
| 980 | |2 2001 |1 01 |x DE-21 |b 4261728621 |c 00 |f --%%-- |d --%%-- |e --%%-- |j kp |y l01 |z 01-02-23 | ||
| 980 | |2 2003 |1 01 |x DE-25 |b 4329388375 |c 00 |f --%%-- |d --%%-- |e --%%-- |j n |k Elektronischer Volltext - Universitätslizenz. - Der Online-Zugriff auf die "RSC eBook Collection 2022" wird im Rahmen eines Nationalkonsortiums bereitgestellt und durch die Technische Informationsbibliothek Hannover (TIB) organisiert. |y l01 |z 05-06-23 | ||
| 980 | |2 2005 |1 05 |x DE-291-415 |b 4256791167 |c 00 |f --%%-- |d e-book |e --%%-- |j n |y l05 |z 01-02-23 | ||
| 980 | |2 2014 |1 01 |x DE-90 |b 4256791205 |c 00 |f --%%-- |d --%%-- |e --%%-- |j --%%-- |y l01 |z 01-02-23 | ||
| 980 | |2 2027 |1 01 |x DE-105 |b 438274573X |c 00 |f --%%-- |d --%%-- |e --%%-- |j n |k RSC-eBook-Collection-2022 |y l01 |z 09-10-23 | ||
| 981 | |2 62 |1 01 |x 0028 |r http://dx.doi.org/10.1039/9781839169342 | ||
| 981 | |2 120 |1 01 |x 0715 |r http://49gbv-uob-primo.hosted.exlibrisgroup.com/openurl/49GBV_UOB/UOB_services_page?u.ignore_date_coverage=true&rft.mms_id=991016049423103501 | ||
| 981 | |2 2001 |1 01 |x DE-21 |r http://dx.doi.org/10.1039/9781839169342 | ||
| 981 | |2 2003 |1 01 |x DE-25 |r https://www.redi-bw.de/start/unifr/RSC-ebooks/10.1039/9781839169342 | ||
| 981 | |2 2005 |1 05 |x DE-291-415 |r http://dx.doi.org/10.1039/9781839169342 | ||
| 981 | |2 2014 |1 01 |x DE-90 |y Zugang im Netz des KIT |r http://dx.doi.org/10.1039/9781839169342 | ||
| 982 | |2 2001 |1 01 |x DE-21 |8 00 |s s |a eBook-RSC-eBook-Collection-2022 | ||
| 982 | |2 2027 |1 01 |x DE-105 |8 00 |s s |a ebook | ||
| 983 | |2 2027 |1 01 |x DE-105 |8 00 |0 (DE-627)1293662577 |a DK 541.5 | ||
| 995 | |2 62 |1 01 |x 0028 |a OLR-RSEK | ||
| 995 | |2 70 |1 01 |x 0089 |a OLR-AL-RSE | ||
| 995 | |2 70 |1 01 |x 0089 |a ACQ | ||
| 995 | |2 120 |1 01 |x 0715 |a alma | ||
| 998 | |2 2001 |1 01 |x DE-21 |0 2302 |f 44 | ||
| 998 | |2 2003 |1 01 |x DE-25 |0 2323 |f 15 | ||