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Applications of noisy quantum computing and quantum error mitigation to “adamantaneland”: a benchmarking study for quantum chemistry

Viki Kumar Prasad / Freeman Cheng / Ulrich Fekl / Hans-Arno Jacobsen

Physical Chemistry Chemical Physics, 2024 · Journal Article

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, calculated at a high-level of theory. Using the data set, we compared noiseless VQE simulations to conventionally performed density functional and wavefunction theory-based methods to understand the quality of results. We also investigated the effectiveness of a quantum state tomography-based error mitigation technique in applications of VQE under noise (simulated and real). Our findings reveal that the use of quantum error mitigation is crucial in the NISQ era and advantageous to yield almost noiseless quality results.