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Multi-configurational self-consistent field

Known as: RASSCF, Multi-configurational Hartree-Fock, MCSCF 
Multi-configurational self-consistent field (MCSCF) is a method in quantum chemistry used to generate qualitatively correct reference states of… 
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Papers overview

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Review
2006
Review
2006
We developed the molecular mechanics—valence bond (MMVB) method following an original suggestion of Jean-Paul Malrieu and… 
2001
2001
Theoretical studies of proposed structures for NaN5, KN5, Mg(N5)2, Ca(N5)2, and Zn(N5)2 metal complexed pentazole anions have… 
1997
1997
A comprehensive theoretical and experimental study of the 13C and 77Se nuclear magnetic shieldings and their rovibrational… 
Highly Cited
1996
Highly Cited
1996
Relative energies for different multiplets of trimethylenemethane and methylenecyclopropane are calculated at MCSCF, CASPT2N, and… 
1991
1991
Potential energy surfaces, properties, and spectra of singlet (X1A1) and triplet (a3B2) ozone are investigated by means of MCSCF… 
Highly Cited
1986
Highly Cited
1986
Full configuration‐interaction (FCI) calculations are performed at selected geometries for the 1∑+ state of HF and the 2B1 and… 
1983
1983
On montre que l'arrachement par le radical methyle est plus facile que par le radical silyl