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Published in 2022 at "Journal of chemical theory and computation"
DOI: 10.1021/acs.jctc.2c00403
Abstract: The variational quantum eigensolver (VQE) algorithm can simulate the chemical systems such as molecules in the noisy-intermediate-scale quantum devices and shows promising applications in quantum chemistry simulations. The accuracy and computational cost of the VQE…
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Keywords:
adapt vqe;
vqe algorithm;
quantum eigensolver;
quantum ... See more keywords
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Published in 2024 at "Journal of Chemical Theory and Computation"
DOI: 10.1021/acs.jctc.4c00329
Abstract: The adaptive derivative-assembled pseudo-Trotter variational quantum eigensolver (ADAPT-VQE) has emerged as a pivotal promising approach for electronic structure challenges in quantum chemistry with noisy quantum devices. Nevertheless, to surmount existing technological constraints, this study endeavors…
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Keywords:
chemistry;
adapt vqe;
variational quantum;
physically motivated ... See more keywords
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Published in 2025 at "Journal of Chemical Theory and Computation"
DOI: 10.1021/acs.jctc.5c00535
Abstract: The adaptive derivative-assembled problem-tailored variational quantum eigensolver (ADAPT-VQE) is one of the most widely used algorithms for electronic structure calculations in quantum computers. It adaptively selects operators based on their gradient, constructing ansätze that continuously…
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Keywords:
adapt vqe;
ans tze;
compacting molecular;
pruned adapt ... See more keywords