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Open shell

Known as: Closed shell 
In the context of atomic orbitals, an open shell is a valence shell which is not completely filled with electrons or that has not given all of its… 
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Related topics

Related topics

7 relations
Anna KrylovHartree–Fock methodJahn–Teller effectMolecular orbital

Broader (1)

Computational chemistry

Papers overview

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Highly Cited
2013
Highly Cited
2013
Role of the two- and three-body hyperon-nucleon interaction in $\Lambda$-hypernuclei
We discuss the effect of the hyperon-nucleon-nucleon interaction on the binding energy of a $\Lambda$ hyperon in closed shell… 
Highly Cited
2008
Highly Cited
2008
Scioto: A Framework for Global-View Task Parallelism
We introduce Scioto, shared collections of task objects, a lightweight framework for providing task management on distributed… 
2002
2002
Relativistic Mean-Field Theory with the Pion in Finite Nuclei
We study the possibility of the existence of a finite pion mean field in finite nuclei in the relativistic mean-field (RMF… 
2000
2000
Displacement energies with the Skyrme Hartree–Fock method
1998
1998
Valence orbital electron momentum distributions for oxygen: comparison of EMS measurements with theory
Highly Cited
1992
Highly Cited
1992
Model calculations of doubly closed shell nuclei in CBF theory: II. One body density matrix and momentum distribution
1987
1987
Ab initio molecular orbital studies of closed shell flavins
Ab initio calculations with a (7 s 3 p) basis set are performed on uracil, lumazine, alloxazine and various isoalloxazines. The… 
1987
1987
Insertion of methylene into ethane and cyclopropane
The insertions of methylene into the CH and CC bonds of ethane and into a CC bond of cyclopropane are calculated by using third… 
Highly Cited
1984
Highly Cited
1984
Carbene and Silylene Insertion Reactions. Ab Initio Calculations on the Effects of Fluorine Substitution
The insertion reactions of CH,, CHF, CF2, SiH2, SiHF, and SiF2 into hydrogen molecule have been investigated by ab initio… 
Highly Cited
1957
Highly Cited
1957
CENTER-OF-GRAVITY THEOREM IN NUCLEAR SPECTROSCOPY
The j-j coupling shell model implies the existence of certain geometrical relations among the spectra of neighboring nuclei. One… 
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