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9 lines
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9 lines
286 B
ReStructuredText
* The atomic orbitals are normalized:
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.. math::
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\int \left(\chi_i({\bf r}) \right)^2 dr = 1
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* The AO coefficients in the EZFIO files are not necessarily normalized and are normalized after reading
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* The AO coefficients and exponents are ordered in increasing order of exponents
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