Scalable neural quantum states architecture for quantum chemistry
Variational optimization of neural-network representations of quantum states has been
successfully applied to solve interacting fermionic problems. Despite rapid developments …
successfully applied to solve interacting fermionic problems. Despite rapid developments …
Automated translation and accelerated solving of differential equations on multiple GPU platforms
We demonstrate a high-performance vendor-agnostic method for massively parallel solving
of ensembles of ordinary differential equations (ODEs) and stochastic differential equations …
of ensembles of ordinary differential equations (ODEs) and stochastic differential equations …
NNQS-transformer: an efficient and scalable neural network quantum states approach for ab initio quantum chemistry
Y Wu, C Guo, Y Fan, P Zhou, H Shang - Proceedings of the International …, 2023 - dl.acm.org
Neural network quantum state (NNQS) has emerged as a promising candidate for quantum
many-body problems, but its practical applications are often hindered by the high cost of …
many-body problems, but its practical applications are often hindered by the high cost of …
Accelerating variational quantum Monte Carlo using the variational quantum eigensolver
Variational Monte Carlo (VMC) methods are used to sample classically from distributions
corresponding to quantum states which have an efficient classical description. VMC …
corresponding to quantum states which have an efficient classical description. VMC …
Impact of conditional modelling for a universal autoregressive quantum state
We present a generalized framework to adapt universal quantum state approximators,
enabling them to satisfy rigorous normalization and autoregressive properties. We also …
enabling them to satisfy rigorous normalization and autoregressive properties. We also …
Numerical and geometrical aspects of flow-based variational quantum Monte Carlo
This article aims to summarize recent and ongoing efforts to simulate continuous-variable
quantum systems using flow-based variational quantum Monte Carlo techniques, focusing …
quantum systems using flow-based variational quantum Monte Carlo techniques, focusing …
An empirical study of quantum dynamics as a ground state problem with neural quantum states
Abstract We consider the Feynman–Kitaev formalism applied to a spin chain described by
the transverse-field Ising model. This formalism consists of building a Hamiltonian whose …
the transverse-field Ising model. This formalism consists of building a Hamiltonian whose …
Retentive Neural Quantum States: Efficient Ans\" atze for Ab Initio Quantum Chemistry
Neural-network quantum states (NQS) has emerged as a powerful application of quantum-
inspired deep learning for variational Monte Carlo methods, offering a competitive …
inspired deep learning for variational Monte Carlo methods, offering a competitive …
Bayesian Modelling Approaches for Quantum States--The Ultimate Gaussian Process States Handbook
Y Rath - arxiv preprint arxiv:2308.07669, 2023 - arxiv.org
Capturing the correlation emerging between constituents of many-body systems accurately
is one of the key challenges for the appropriate description of various systems whose …
is one of the key challenges for the appropriate description of various systems whose …
Meta-variational quantum Monte Carlo
Motivated by close analogies between meta-reinforcement learning (Meta-RL) and
variational quantum Monte Carlo with disorder, we propose a learning problem and an …
variational quantum Monte Carlo with disorder, we propose a learning problem and an …