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Amantadine,Density functional theory,NBO,Atom in molecule,Natural bond orbital
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https://doi.org/10.1007/s00214-020-02672-2
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Theoretical Chemistry Accounts, https://doi.org/10.1007/s00214-020-02672-2
Amantadine
Density functional theory
NBO
Atom in molecule
Natural bond orbital
Theoretical study of the adsorption of amantadine on pristine, Al-, Ga-, P-, and As-doped boron nitride nanosheets: a PBC-DFT, NBO, and QTAIM study
Mohsen Doust Mohammadi
Hewa Y. Abdullah
10.1007/s00214-020-02672-2
2010-04-23
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