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https://github.com/LCPQ/quantum_package
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8 lines
249 B
Plaintext
8 lines
249 B
Plaintext
mo_basis
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mo_tot_num integer
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mo_coef double precision (ao_basis_ao_num,mo_basis_mo_tot_num)
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mo_label character*(64)
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mo_occ double precision (mo_basis_mo_tot_num)
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ao_md5 character*(32)
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