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Bug in quickstart
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@ -115,7 +115,7 @@ create an |EZFIO| database with the 6-31G basis set:
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.. code:: bash
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.. code:: bash
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qp create_ezfio -b "6-31G" hcn.xyz -o hcn
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qp create_ezfio -b "6-31g" hcn.xyz -o hcn
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The EZFIO database now contains data relative to the nuclear coordinates
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The EZFIO database now contains data relative to the nuclear coordinates
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and the atomic basis set:
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and the atomic basis set:
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