2 papers
physics.comp-ph2024
Classification of electronic structures and state preparation for quantum computation of reaction chemistry
Maximilian Mörchen, Guang Hao Low, Thomas Weymuth +3
Quantum computation for chemical problems will require the construction of guiding states with sufficient overlap with a target state. Since easily available and initializable mean…
quant-ph2024
End-to-End Quantum Simulation of a Chemical System
Wim van Dam, Hongbin Liu, Guang Hao Low +6
We demonstrate the first end-to-end integration of high-performance computing (HPC), reliable quantum computing, and AI in a case study on catalytic reactions producing chiral mole…