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Published in 2025 at "Journal of chemical theory and computation"
DOI: 10.1021/acs.jctc.5c01407
Abstract: Quantum Selected Configuration Interaction (QSCI) and an extended protocol known as Sample-based Quantum Diagonalization (SQD) have emerged as promising algorithms to solve the electronic Schrödinger equation with noisy quantum computers. In QSCI/SQD a quantum circuit…
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Keywords:
sample based;
based quantum;
quantum diagonalization;
auxiliary field ... See more keywords
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Published in 2018 at "Journal of chemical theory and computation"
DOI: 10.1021/acs.jctc.8b00342
Abstract: We present an implementation of phaseless Auxiliary-Field Quantum Monte Carlo (ph-AFQMC) utilizing graphical processing units (GPUs). The AFQMC method is recast in terms of matrix operations which are spread across thousands of processing cores and…
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Keywords:
phaseless auxiliary;
graphical processing;
auxiliary field;
monte carlo ... See more keywords