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Paper

Continuous symmetry measures of irreducible representations: application to molecular orbitals

Pere Alemany,*ab   David Casanovaab and   Santiago Álvarezbc  
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a
Departament de Química Física, Universitat de Barcelona, Martí i Franquès 1-11, 08028 Barcelona, Spain
E-mail: p.alemany@ub.edu
b
Institut de Química Teòrica i Computacional (IQTCUB), Universitat de Barcelona, Martí i Franquès 1-11, 08028 Barcelona, Spain
c
Departament de Química Inorgànica, Universitat de Barcelona, Martí i Franquès 1-11, 08028 Barcelona, Spain
Phys. Chem. Chem. Phys., 2012,14, 11816-11823

DOI: 10.1039/C2CP41506B
Received 10 May 2012, Accepted 30 May 2012
First published online 25 Jul 2012
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