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Quantum Chemistry (CM-QC)10 ECTS (englische Bezeichnung: Quantum Chemistry)
Modulverantwortliche/r: Andreas Görling Lehrende:
Andreas Görling, Christian Neiß
Startsemester: |
WS 2020/2021 | Dauer: |
2 Semester | Turnus: |
jährlich (WS) |
Präsenzzeit: |
90 Std. | Eigenstudium: |
210 Std. | Sprache: |
Englisch |
Lehrveranstaltungen:
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- Quantum Chemistry - WS:
Winter Term:
1. Quantum Chemistry 1 (2V)
2. Quantum Chemistry 1 Seminar (1S)
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Quantum Chemistry I (WS 2020/2021)
(Vorlesung mit Übung, 3 SWS, Andreas Görling et al., Di, 8:15 - 10:45, 0.113-12; Please note: Room specifications are only relevant if face-to-face teaching may become possible during the lecture period.)
- Quantum Chemistry - SS:
Summer Term:
3. Quantum Chemistry 2 (2V)
4. Quantum Chemistry 2 Seminar (1S)
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Quantum Chemistry II (SS 2021)
(Vorlesung mit Übung, 3 SWS, Andreas Görling et al., Di, 14:15 - 16:45, H2 Egerlandstr.3; Please note: Room specifications are only relevant if face-to-face teaching may become possible during the lecture period.)
Inhalt:
- Introduction to modern methods and current research issues in the field of quantum and computer chemistry
Hartree-Fock, DFT, Many Body Perturbation Theory
Configuration Interaction, Second Quantization, Coupled Cluster
TD-HF, TD-DFT, RPA
Lernziele und Kompetenzen:
Students ...
obtain sound knowledge in basic and advanced methods of quantum chemistry
are able to solve mathematical problems occurring in quantum chemistry
are able to understand and assess scientific reports in the field of quantum chemistry
Literatur:
- Attila Szabo, Neil S. Ostlund: Modern Quantum Chemistry, Dover 1996
Frank Jensen: Introduction to Computational Chemistry, Wiley 2017 (3rd ed.)
Ira N. Levine: Quantum Chemistry, Pearson 2016 (7th ed.)
Bemerkung:
Module compatibility:
Lecture module within the Core module „Quantum Chemistry“ in M. Sc. Chemistry
Lecture module within the Compulsory Elective Module in M.Sc. Chemistry (if not chosen as Core module) or M. Sc. Molecular Science
Organisatorisches:
- The core module "Quantum Chemistry" starts only in winter term!
Quantum Chemistry (CM-QC/QuantCh) will be taught online (synchronous/asynchronous) in winter term 20/21 and summer term 21 until further notice
Students have to register for this module (check registration periods)!
Registration/further information via StudOn!
Weitere Informationen:
www: https://www.studon.fau.de/crs3274705.html
Verwendbarkeit des Moduls / Einpassung in den Musterstudienplan: Das Modul ist im Kontext der folgenden Studienfächer/Vertiefungsrichtungen verwendbar:
- Molecular Science (Master of Science): ab 1. Semester
(Po-Vers. 2020w | NatFak | Molecular Science (Master of Science) | Compulsory elective module | Quantum Chemistry | Quantum Chemistry)
Studien-/Prüfungsleistungen:
Quantum Chemistry (Prüfungsnummer: 65071)
- Prüfungsleistung, mündliche Prüfung, Dauer (in Minuten): 30, benotet, 10 ECTS
- Anteil an der Berechnung der Modulnote: 100.0 %
- weitere Erläuterungen:
O30 (PL): Oral Examination (30 minutes) or alternative examination according to FAU Corona Statutes!
- Prüfungssprache: Englisch
- Erstablegung: SS 2021, 1. Wdh.: WS 2021/2022
1. Prüfer: | Andreas Görling |
- Ort: P 3.88
Ort: P 3.88 (Egerlandstr. 3)
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