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Prediction of molecular dipole moments from bond moments: testing of the method by DFT calculations on isolated molecules

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    0100789 - UOCHB-X 20043014 RIV GB eng J - Journal Article
    Böhm, S. - Exner, Otto
    Prediction of molecular dipole moments from bond moments: testing of the method by DFT calculations on isolated molecules.
    [Predikace molekulárního dipólového momentu z vazebných momentů: test metody pomocí DFT výpočtů na izolovaných molekulách.]
    Physical Chemistry Chemical Physics. Roč. 6, - (2004), s. 510-514. ISSN 1463-9076. E-ISSN 1463-9084
    R&D Projects: GA MŠMT LN00A032
    Institutional research plan: CEZ:AV0Z4055905
    Keywords : DFT calculations
    Subject RIV: CF - Physical ; Theoretical Chemistry
    Impact factor: 2.076, year: 2004
    Permanent Link: http://hdl.handle.net/11104/0008278
     

Number of the records: 1  

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