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On the concepts of connectivity, separability, and consistency: An illustration by partitioned diagrams and numerical probing
British Library Online Contents | 2009| -
An exponential multi-reference wavefunction ansatz: connectivity analysis and application to N2
British Library Online Contents | 2008| -
Wavefunction quality and error estimation of single- and multi-reference coupled-cluster and CI methods: The Formula Not Shown model system
British Library Online Contents | 2008| -
Multi-reference coupled-cluster study of the ionic-neutral curve crossing LiF
British Library Online Contents | 2008| -
Initial applications of an exponential multi-reference wavefunction ansatz
British Library Online Contents | 2006| -
Wavefunction quality of single- and multi-reference coupled-cluster and configuration interaction methods: The P4 and H8 model systems
British Library Online Contents | 2012| -
Localization scheme for relativistic spinors
National licenceAmerican Institute of Physics | 2011| -
A Theoretical Comparison of Two Competing Diradical Cyclizations in Enyne-Allenes: The Myers−Saito and the Novel C2−C6 Cyclization
American Chemical Society | 1998| -
Theoretische Chemie: Subsystem-Methoden in der DFT beschreiben Molekule in komplexen Umgebungen sowie grosse molekulare Aggregate - Multireferenzansatze erhohen die Effizienz der Coupled-Cluster-Methoden - Quantendynamik: Lichtinduzierte nichtadiabatische Molekulardynamik und Quantenkontrolle in komplexen Systemen
British Library Online Contents | 2013| -
Dissociating N2: a multi-reference coupled cluster study on the potential energy surfaces of ground and excited states
British Library Online Contents | 2009| -
A multi-reference coupled-cluster study on the potential energy surface of N2 including ground and excited states: spin projections and wavefunction overlaps
British Library Online Contents | 2009| -
Multi-reference coupled-cluster study of the potential energy surface of the hydrogen fluoride dissociation including excited states
British Library Online Contents | 2009| -
Do primary nitrosamines form and exist in the gas phase? A computational study of CH3NHNO and (CH3)2NNO
British Library Online Contents | 2012| -
Fully Automated Implementation of the Incremental Scheme for Correlation Energies
British Library Online Contents | 2010| -
Using symmetry in the framework of the incremental scheme: Molecular applications
British Library Online Contents | 2008| -
Energy Screening for the Incremental Scheme: Application to Intermolecular Interactions
British Library Online Contents | 2007| -
Error analysis of incremental electron correlation calculations and applications to clusters and potential energy surfaces
British Library Online Contents | 2007|
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