Electron momentum spectroscopy study of amantadine: binding energy spectra and valence orbital electron density distributions
作者： I.V Litvinyuk , Y Zheng , C.E Brion
DOI: 10.1016/S0301-0104(00)00289-5
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摘要: The electron binding energy spectrum and valence orbital electron momentum density distributions of amantadine (1-aminoadamantane), an important anti-viral and anti-Parkinsonian drug, have been measured by electron momentum spectroscopy. Theoretical momentum distributions, calculated at the 6-311++ G** and AUG-CC-PVTZ levels within the target Hartree–Fock and also the target Kohn–Sham density functional theory approximations, show good agreement with the experimental results. The results for …
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