A tailored quantum multi-programming workflow for the LUCJ ansatz enables parallel circuit execution with SQD/ext-SQD post-processing that mitigates cross-talk, yielding ethanol energies within 0.001 kcal/mol of classical HCI references.
Warshel \ and\ author M
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An updated LAMMPS version of H-AdResS enables dual-resolution simulations of interfaces in porous solids, keeping atomistic accuracy while raising efficiency.
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A Quantum Multi-Programming Framework to Maximize Quantum Resources for the LUCJ Ansatz
A tailored quantum multi-programming workflow for the LUCJ ansatz enables parallel circuit execution with SQD/ext-SQD post-processing that mitigates cross-talk, yielding ethanol energies within 0.001 kcal/mol of classical HCI references.
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Extending Hamiltonian-Adaptive Resolution Simulation to Interfaces: An Updated LAMMPS Implementation and Application to Porous Solids
An updated LAMMPS version of H-AdResS enables dual-resolution simulations of interfaces in porous solids, keeping atomistic accuracy while raising efficiency.