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17 lines
403 B
INI
17 lines
403 B
INI
[grid_type_sgn]
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type: integer
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doc: Type of grid used for the Becke's numerical grid. Can be, by increasing accuracy: [ 0 | 1 | 2 | 3 ]
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interface: ezfio,provider,ocaml
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default: 2
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[n_points_final_grid]
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type: integer
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doc: Total number of grid points
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interface: ezfio
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[thresh_grid]
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type: double precision
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doc: threshold on the weight of a given grid point
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interface: ezfio,provider,ocaml
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default: 1.e-20
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