Given the standard output
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QM/MM Energy
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quantum energy -537.200184022 (-.141042E+07 kjoule/mol)
quantum energy adjusted -537.200184022 (-.141042E+07 kjoule/mol)
quantum energy internal -537.135248946 (-.141025E+07 kjoule/mol)
Bq-nuclear energy 3.733295197 (0.980177E+04 kjoule/mol)
Bq-electron energy -3.798230274 (-.997225E+04 kjoule/mol)
classical energy -16.117550021 (-.423166E+05 kjoule/mol)
total qmmm energy -553.317734044 (-.145274E+07 kjoule/mol)
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the electrostatic interaction energy can be calculated as sum of "Bq-nuclear energy" and "Bq-electron energy", or as a difference between
"quantum energy" and "quantum energy internal". Vdw interaction energy and others ( e.g. bonded, etc) are unfortunately buried in the "classical energy" term. Please note that a single interaction energy number would likely be meaningless.
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