A DMET-VQE co-optimization framework reduces qubit requirements and enables equilibrium geometry optimization for molecules up to the size of glycolic acid C2H4O3.
J.; Aspuru-Guzik, A.; O’brien, J
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Large-scale Efficient Molecule Geometry Optimization with Hybrid Quantum-Classical Computing
A DMET-VQE co-optimization framework reduces qubit requirements and enables equilibrium geometry optimization for molecules up to the size of glycolic acid C2H4O3.