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The initially phase in solving a quantum chemical predicament is generally solving the Schrodinger equation (or Dirac equation in relativistic quantum chemistry) while using the digital molecular Hamiltonian.

This is called identifying the digital construction of your molecule. It might be said which the digital composition of the molecule or crystal indicates essentially its chemical houses. A precise…

להמשך קריאהThe initially phase in solving a quantum chemical predicament is generally solving the Schrodinger equation (or Dirac equation in relativistic quantum chemistry) while using the digital molecular Hamiltonian.

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