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Unbiasing fermionic auxiliary-field quantum Monte Carlo with matrix product state trial wavefunctions
In this work, we report, for the first time, an implementation of fermionic auxiliary-field
quantum Monte Carlo (AFQMC) using matrix product state (MPS) trial wavefunctions …
quantum Monte Carlo (AFQMC) using matrix product state (MPS) trial wavefunctions …
Quantum Computing Approach to Fixed-Node Monte Carlo Using Classical Shadows
Quantum Monte Carlo (QMC) methods are powerful approaches for solving electronic
structure problems. Although they often provide high-accuracy solutions, the precision of …
structure problems. Although they often provide high-accuracy solutions, the precision of …
Self-Refinement of Auxiliary-Field Quantum Monte Carlo via Non-Orthogonal Configuration Interaction
For optimal accuracy, auxiliary-field quantum Monte Carlo (AFQMC) requires trial states
consisting of multiple Slater determinants. We develop an efficient algorithm to select the …
consisting of multiple Slater determinants. We develop an efficient algorithm to select the …