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Coordinates, Basis sets, Fragments
Coordinates, Basis sets, Fragments
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See also:
ADF-GUI tutorial:
building molecules
,
basis set effects
,
fragments
Atomic coordinates
Cartesian
Z-Matrix
Orientation of Local Atomic Coordinates
Symmetry Key
Basis sets and atomic fragments
STO basis sets
Available basis sets
The Basis Key
Automatic mode
Create mode
Ghost Atoms, Non-standard Chemical Elements
Nuclear Model
Molecular fragments
Fragment mode
Fragment files