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https://github.com/LCPQ/quantum_package
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13 lines
674 B
Plaintext
13 lines
674 B
Plaintext
aux_basis
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aux_basis_num integer
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aux_basis_num_sqrt integer
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aux_basis_idx integer (2,aux_basis_aux_basis_num)
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aux_basis_prim_num integer (aux_basis_aux_basis_num_sqrt)
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aux_basis_nucl integer (aux_basis_aux_basis_num_sqrt)
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aux_basis_power integer (aux_basis_aux_basis_num_sqrt,3)
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aux_basis_prim_num_max integer = maxval(aux_basis_aux_basis_prim_num)
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aux_basis_coef double precision (aux_basis_aux_basis_num_sqrt,aux_basis_aux_basis_prim_num_max)
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aux_basis_expo double precision (aux_basis_aux_basis_num_sqrt,aux_basis_aux_basis_prim_num_max)
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