Gast ::
| Hauptseite > Publikationsdatenbank > Calculations of atomic multiplets across the periodic table > print |
| Hauptseite > Publikationsdatenbank > Calculations of atomic multiplets across the periodic table > print |
| 001 | 188242 | ||
| 005 | 20210129215149.0 | ||
| 024 | 7 | _ | |2 Handle |a 2128/8437 |
| 037 | _ | _ | |a FZJ-2015-01684 |
| 100 | 1 | _ | |0 P:(DE-HGF)0 |a Zhang, Qian |b 0 |e Corresponding Author |g male |
| 245 | _ | _ | |a Calculations of atomic multiplets across the periodic table |f 2014-09-01 |
| 260 | _ | _ | |c 2014 |
| 300 | _ | _ | |a 95 p. |
| 336 | 7 | _ | |0 PUB:(DE-HGF)19 |2 PUB:(DE-HGF) |a Master Thesis |b master |m master |s 1425371669_24702 |
| 336 | 7 | _ | |0 2 |2 EndNote |a Thesis |
| 336 | 7 | _ | |2 DataCite |a Output Types/Supervised Student Publication |
| 336 | 7 | _ | |2 DRIVER |a masterThesis |
| 336 | 7 | _ | |2 ORCID |a SUPERVISED_STUDENT_PUBLICATION |
| 336 | 7 | _ | |2 BibTeX |a MASTERSTHESIS |
| 502 | _ | _ | |a RWTH Aachen, Masterarbeit, 2014 |b MS |c RWTH Aachen |d 2014 |
| 520 | _ | _ | |a The goal of this thesis is to develop a simulation tool for the calculation and visualization of the multiplet structure of all atoms across the periodic table. The starting point are self- consistent calculations in the spherical-potential approximation. For the resulting atomic levels we calculate the ab-initio Slater parameters that define the electron-electron repulsion term of the many-body Hamiltonian. We then construct the eigen-states of the Hamiltonian on an open shell by constructing the multiplet states using the angular momentum ladder operators and, where necessary, seniority. Finally, we include spin-orbit coupling, using the ab-initio coupling constants determined from the self-consistent radial potentials. |
| 536 | _ | _ | |0 G:(DE-HGF)POF2-424 |a 424 - Exploratory materials and phenomena (POF2-424) |c POF2-424 |f POF II |x 0 |
| 536 | _ | _ | |0 G:(DE-HGF)POF2-89574 |a 89574 - Theory, modelling and simulation (POF2-89574) |c POF2-89574 |f POF II T |x 1 |
| 650 | _ | 7 | |0 V:(DE-588b)4276536-5 |2 GND |a Unveröffentlichte Hochschulschrift |x Masterarbeit |
| 773 | _ | _ | |y 2014 |
| 856 | 4 | _ | |u https://juser.fz-juelich.de/record/188242/files/FZJ-2015-01684.pdf |y OpenAccess |
| 856 | 4 | _ | |u https://juser.fz-juelich.de/record/188242/files/FZJ-2015-01684.jpg?subformat=icon-144 |x icon-144 |y OpenAccess |
| 856 | 4 | _ | |u https://juser.fz-juelich.de/record/188242/files/FZJ-2015-01684.jpg?subformat=icon-180 |x icon-180 |y OpenAccess |
| 856 | 4 | _ | |u https://juser.fz-juelich.de/record/188242/files/FZJ-2015-01684.jpg?subformat=icon-640 |x icon-640 |y OpenAccess |
| 909 | C | O | |o oai:juser.fz-juelich.de:188242 |p openaire |p open_access |p VDB |p driver |p dnbdelivery |
| 913 | 2 | _ | |0 G:(DE-HGF)POF3-574 |1 G:(DE-HGF)POF3-570 |2 G:(DE-HGF)POF3-500 |a DE-HGF |b Key Technologies |l Decoding the Human Brain |v Theory, modelling and simulation |x 0 |
| 913 | 1 | _ | |0 G:(DE-HGF)POF2-424 |1 G:(DE-HGF)POF2-420 |2 G:(DE-HGF)POF2-400 |a DE-HGF |b Schlüsseltechnologien |v Exploratory materials and phenomena |x 0 |4 G:(DE-HGF)POF |3 G:(DE-HGF)POF2 |l Grundlagen zukünftiger Informationstechnologien |
| 913 | 1 | _ | |0 G:(DE-HGF)POF2-89574 |a DE-HGF |v Theory, modelling and simulation |x 1 |4 G:(DE-HGF)POF |1 G:(DE-HGF)POF3-890 |3 G:(DE-HGF)POF3 |2 G:(DE-HGF)POF3-800 |b Programmungebundene Forschung |l ohne Programm |
| 914 | 1 | _ | |y 2014 |
| 915 | _ | _ | |0 StatID:(DE-HGF)0510 |2 StatID |a OpenAccess |
| 920 | _ | _ | |l no |
| 920 | 1 | _ | |0 I:(DE-588b)1026307295 |k GRS |l German Research School for Simulation Sciences |x 0 |
| 980 | _ | _ | |a master |
| 980 | _ | _ | |a VDB |
| 980 | _ | _ | |a UNRESTRICTED |
| 980 | _ | _ | |a FullTexts |
| 980 | _ | _ | |a I:(DE-588b)1026307295 |
| 980 | 1 | _ | |a FullTexts |
| Library | Collection | CLSMajor | CLSMinor | Language | Author |
|---|