- Location
-
Deutsche Nationalbibliothek Frankfurt am Main
- Extent
-
Online-Ressource
- Language
-
Englisch
- Bibliographic citation
-
In: Journal of Chemical Physics (1994) 100, 2936-2942.
- Classification
-
Chemie
- Keyword
-
Organische Chemie
- Event
-
Veröffentlichung
- (where)
-
Würzburg
- (who)
-
Universität Würzburg
- (when)
-
2011
- Creator
-
Suter, H. U.
Engels, Bernd
- URN
-
urn:nbn:de:bvb:20-opus-59029
- Rights
-
Der Zugriff auf das Objekt ist unbeschränkt möglich.
- Last update
-
14.08.2025, 10:51 AM CEST
Data provider
This object is provided by:
Deutsche Nationalbibliothek. If you have any questions about the object, please contact the data provider.
Deutsche Nationalbibliothek. If you have any questions about the object, please contact the data provider.
Associated
- Suter, H. U.
- Engels, Bernd
- Universität Würzburg
Time of origin
- 2011
Other Objects (12)
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Estimation of the influence of the configurations neglected within truncated MR-CI wavefunctions on molecular properties
Study of influences of various excitation classes on ab initio calculated isotropic hyperfine coupling constants
Detailed study of the configuration selected multi-reference configuration interaction method combined with perturbation theory to correct the wave function
Computational Investigation of Pathogenic Enzymes and their Covalent Inhibition
Development of Accurate Physically Grounded Force Fields for Intermolecular Cation-$\pi$ Interactions based on SAPT Energy Decomposition Analysis and Computational Investigation of Covalent Irreversible Vinyl Sulfone-based Protease Inhibitors
Combining Pyrrole with Boron: Theoretical Investigations and Synthetic Approaches towards Pyrryl-Borane Materials
Theoretical Study of the Dimethylamino Radical (CH3)2N and its protonated cation (CH3)2NH+
Theoretical study of the potential energy surface governing the stereochemistry in ClC2H4 reactions
Untersuchung von Hyperfeinkopplungskonstanten in Abhängigkeit von Basissatz und CI-Parametern
Theoretical study of FC2H4
Theoretical study of the bridging in β-Halo Ethyl
Theoretical Investigations on the Interactions of Small Compounds with their Molecular Environments
Estimation of the influence of the configurations neglected within truncated MR-CI wavefunctions on molecular properties
Study of influences of various excitation classes on ab initio calculated isotropic hyperfine coupling constants
Detailed study of the configuration selected multi-reference configuration interaction method combined with perturbation theory to correct the wave function
Computational Investigation of Pathogenic Enzymes and their Covalent Inhibition
Development of Accurate Physically Grounded Force Fields for Intermolecular Cation-$\pi$ Interactions based on SAPT Energy Decomposition Analysis and Computational Investigation of Covalent Irreversible Vinyl Sulfone-based Protease Inhibitors
Combining Pyrrole with Boron: Theoretical Investigations and Synthetic Approaches towards Pyrryl-Borane Materials
Theoretical Study of the Dimethylamino Radical (CH3)2N and its protonated cation (CH3)2NH+
Theoretical study of the potential energy surface governing the stereochemistry in ClC2H4 reactions
Untersuchung von Hyperfeinkopplungskonstanten in Abhängigkeit von Basissatz und CI-Parametern
Theoretical study of FC2H4
Theoretical study of the bridging in β-Halo Ethyl
Theoretical Investigations on the Interactions of Small Compounds with their Molecular Environments
Estimation of the influence of the configurations neglected within truncated MR-CI wavefunctions on molecular properties
Study of influences of various excitation classes on ab initio calculated isotropic hyperfine coupling constants
Detailed study of the configuration selected multi-reference configuration interaction method combined with perturbation theory to correct the wave function
Computational Investigation of Pathogenic Enzymes and their Covalent Inhibition
Development of Accurate Physically Grounded Force Fields for Intermolecular Cation-$\pi$ Interactions based on SAPT Energy Decomposition Analysis and Computational Investigation of Covalent Irreversible Vinyl Sulfone-based Protease Inhibitors
Combining Pyrrole with Boron: Theoretical Investigations and Synthetic Approaches towards Pyrryl-Borane Materials
Theoretical Study of the Dimethylamino Radical (CH3)2N and its protonated cation (CH3)2NH+