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Configuration interaction

Known as: CI, Configuration Interaction Singles 
Configuration interaction (CI) is a post-Hartree–Fock linear variational method for solving the nonrelativistic Schrödinger equation within the Born… 
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Related topics

Related topics

31 relations
Ab initio quantum chemistry methodsCOLUMBUSComputational chemistryCoupled cluster

Papers overview

Semantic Scholar uses AI to extract papers important to this topic.
2010
2010
Geometric numerical integration for complex dynamics of tethered spacecraft
This paper presents an analytical model and a geometric numerical integrator for a tethered spacecraft model that is composed of… 
2009
2009
Mixed-Initiative Cyber Security: Putting humans in the right loop
In recent years, organizations and their computer infrastructures have grown intertwined in complex relationships through mergers… 
2003
2003
An R-matrix with pseudo states calculation of electron-impact excitation in Ar
Electron-impact excitation of neutral argon is of both fundamental and applied interest. It has been studied theoretically and… 
2003
2003
Surface Processes Induced by Collisions
Energetic gas-phase particles that collide with adsorbed species on solid surfaces induce a variety of processes. Collision… 
1998
1998
Direct Experimental Comparison of the Theories of Thermal and Optical Electron-Transfer: Studies of a Mixed-Valence Dinuclear Iron Polypyridyl Complex
The spectral parameters for the optically induced intervalence charge transfer and the rates of thermal electron transfer as a… 
Highly Cited
1996
Highly Cited
1996
Transition probabilities for forbidden lines of Fe III
Radiative transition probabilities have been calculated for states within the 3d 6 conguration of Fe III. Magnetic dipole (M1… 
Highly Cited
1993
Highly Cited
1993
Evidence of calcium(2+)-dependent carbohydrate association through ion spray mass spectrometry
The interactions of the cell-surface carbohydrate, Le x (Gal-β-1→4-(Fuc-α-1→3)-GlcNAc) and the Le x -containing glycosphingolipid… 
1988
1988
Thermochemistry of silaethylene and methylsilylene from experiment and theory
Utilisation de la spectrometrie de resonance cyclotronique ionique a transformee de Fourier pour l'energetique de la… 
1984
1984
Alkali oxides. Analysis of bonding and explanation of the reversal in ordering of the 2.PI. and 2.SIGMA. states
Etude de la liaison dans MO (M=Li, Na, K, Rb, Cs) a l'aide de fonctions d'onde correlees ab initio: etat fondamental 2 Π pour M… 
1959
1959
Nuclear spin interactions in ferromagnetics and antiferromagnets
In a ferromagnetic or antiferromagnetic crystal the hyperfine coupling between the electrons and the nuclei of the magnetic or… 
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