qrunch.chemistry.calculators
Calculators for chemistry problems.
Modules
Ground state energy calculator using (Pair) Configuration Interaction. |
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Classes for calculating the ground state energy of a molecule using a VQE algorithm. |
Calculators for chemistry problems.
Modules
Ground state energy calculator using (Pair) Configuration Interaction. |
|
Classes for calculating the ground state energy of a molecule using a VQE algorithm. |