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20 lines
491 B
INI
20 lines
491 B
INI
[ao_expoim_cosgtos]
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type: double precision
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doc: imag part for Exponents for each primitive of each cosGTOs |AO|
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size: (ao_basis.ao_num,ao_basis.ao_prim_num_max)
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interface: ezfio, provider
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[use_cosgtos]
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type: logical
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doc: If true, use cosgtos for AO integrals
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interface: ezfio,provider,ocaml
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default: False
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[ao_integrals_threshold]
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type: Threshold
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doc: If | (pq|rs) | < `ao_integrals_threshold` then (pq|rs) is zero
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interface: ezfio,provider,ocaml
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default: 1.e-15
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ezfio_name: threshold_ao
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