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Institution
Friedrich-Alexander-Universität Erlangen-Nürnberg
Department Chemie und Pharmazie
Lehrstuhl für Theoretische Chemie
Address
Egerlandstraße 3
91058 Erlangen
Deutschland
GERiT
This institution in GERiT
91058 Erlangen
Projects
Research Grants
Completed projects
Berechnung optoelektronischer Materialeigenschaften mit zeitabhängiger Dichtefunktionaltheorie
(Applicant
Görling, Andreas
)
Dichtefunktionalmethoden mit exaktem lokalen Kohn-Sham-Austauschpotential und orbitalabhängigen Korrelationsfunktionalen
(Applicant
Görling, Andreas
)
Dichtefunktionalmethoden zum Responseverhalten elektronischer Systeme: statische und dynamische Polarisierbarkeit und Hyperpolarisierbarkeiten
(Applicant
Görling, Andreas
)
New density-functional methods for the treatment of excited states and for the description of static correlation
(Applicant
Görling, Andreas
)
Solving longstanding problems of density-functional theory with quantum Monte Carlo
(Applicant
Görling, Andreas
)
Structure / reactivity relationships in N-containing Liquid Organic Hydrogen Carrier (LOHC) systems
(Applicants
Görling, Andreas
;
Papp, Christian
;
Wasserscheid, Peter
)
Theoretische Untersuchungen der Wechselwirkungen elektromagnetischer Felder einschließlich Laserpulse mit Polymeren und Berechnung der nichtlinearen optischen Eigenschaften von Polymeren
(Applicant
Otto, Peter
)
Priority Programmes
Completed projects
Concepts from the optimized potential method and orbital-dependent kernels in time-dependent density-functional theory
(Applicant
Görling, Andreas
)
Dispersion Effects on Reactivity and Chemo-, Regio- and Stereoselectivity in Organocatalysed Domino Reactions: A Joint Experimental and Theoretical Study
(Applicants
Görling, Andreas
;
Tsogoeva, Svetlana
)
Intra- versus intermolecular forces: the influence of solute-solvent interactions on the structure and properties of extended molecules
(Applicant
Imhof, Petra
)
Collaborative Research Centres
Current projects
Atomistic investigations of catalysis at liquid interfaces by density-functional calculations
(Project Head
Görling, Andreas
)
Completed projects
Formation, Structure, Energetics, and Electronic Properties of Carbon-Rich Molecules and Materials by First-Principles Calculations
(Project Head
Görling, Andreas
)
Quantum chemical investigations of electron transfer processes in metal porphyrin systems
(Project Heads
Görling, Andreas
;
Hieringer, Wolfgang
)
Research Units
Completed projects
FOR 1878: funCOS - Functional Molecular Structures on Complex Oxide Surfaces
(Spokesperson
Libuda, Jörg
)
Theory
(Applicants
Görling, Andreas
;
Meyer, Bernd
)
Clusters of Excellence
Completed projects
EXC 315: Engineering of Advanced Materials - Hierarchical Structure Formation for Functional Devices
(Spokesperson
Peukert, Wolfgang
)
Additional Information
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