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Approximate Spin Projection for Geometry Optimization of Biradical Systems: Case Studies of Through-Space and Through-Bond Systems

Natsumi Yasuda,Yasutaka Kitagawa,H. Hatake,Tôru Saitô,Yusuke Kataoka,Toru Matsui+4 more-2012-01-01-Progress in theoretical chemistry and physics
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Keywords

Spin (aerodynamics)Projection (relational algebra)Bond lengthSpace (punctuation)Coupling (piping)Molecular geometrySymmetry (geometry)Geometry

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