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RESEARCH PAPER · Chemical Physics Letters · 2011

Revisiting the foundations of symmetry operation measures for electronic wavefunctions

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Revisiting the foundations of symmetry operation measures for electronic wavefunctionsOriginalContinuous symmetry measures of irreducible representations: application to molecular orbitals12Analyzing the electronic structure of molecules using continuous symmetry measures3Effects of Temperature on the Shape and Symmetry of Molecules and Solids7The determination of point groups from imprecise molecular geometries4Might molecular symmetry operations exist “partially”?4Time‐Dependent Extension of Grimme's Continuous Chirality Measure for Electronic Chirality Flips in Femto‐ and Attosecond Time Domains1

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  1. Continuous symmetry measures of irreducible representations: application to molecular orbitals

    Physical Chemistry Chemical Physics · 2012-01-01

    Pere Alemany, David Casanova, Santiago Álvarez

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  2. Analyzing the electronic structure of molecules using continuous symmetry measures

    International Journal of Quantum Chemistry · 2012-12-06

    Pere Alemany

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  3. Effects of Temperature on the Shape and Symmetry of Molecules and Solids

    Chemistry - A European Journal · 2018-07-19

    Abel Carreras, Efrem Bernuz, Xavier Marugan, Miquel Llunell, Pere Alemany

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  4. The determination of point groups from imprecise molecular geometries

    Journal of Mathematical Chemistry · 2021-11-15

    Peter J. Knowles

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  5. Might molecular symmetry operations exist “partially”?

    Journal of Mathematical Chemistry · 2023-11-29

    Giorgio Celebre

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  6. Time‐Dependent Extension of Grimme's Continuous Chirality Measure for Electronic Chirality Flips in Femto‐ and Attosecond Time Domains

    ChemPhysChem · 2024-06-06

    Yanrong Guo, Dietrich Haase, Jörn Manz, Huihui Wang, Huihui Wang, Yonggang Yang, Yonggang Yang

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