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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
2016
Review
2016
The fact that a new text book introducing the essentials of computational chemistry contains more than 500 pages shows… 
2015
2015
The multi-configurational self-consistent field theory is considered the standard starting point for almost all multireference… 
1999
1999
We report a general method for the calculation of Jahn−Teller coupling constants by ab initio methods widely available today in… 
Highly Cited
1997
Highly Cited
1997
A density functional for dynamical correlation, to be used in connection with wavefunctions of the complete-active-space self… 
Highly Cited
1995
Highly Cited
1995
The effective nuclear charges (Z.,ff), which are empirical parameters in an approximate spin-orbit Hamiltonian, are determined… 
Highly Cited
1993
Highly Cited
1993
A quasidegenerate perturbation theory based on multiconfigurational self‐consistent‐field (MCSCF) reference functions is derived… 
Highly Cited
1993
Highly Cited
1993
A newly proposed quantum chemical approach for ab initio calculations of electronic spectra of molecular systems is applied to… 
Highly Cited
1987
Highly Cited
1987
In characterizing anion states either experimentally or theoretically different techniques are required for bound and temporary… 
Highly Cited
1985
Highly Cited
1985
We have examined the response of an exact and an MCSCF reference state to a general time‐dependent field. The time development of…