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Generalized many-body perturbation theory for the electron correlation energy: multi-reference random phase approximation via diagrammatic resummation
Yuqi Wang, Wei-Hai Fang, Zhendong Li
Many-body perturbation theory (MBPT) based on Green's functions and Feynman diagrams provides a fundamental theoretical framework for various \emph{ab initio} computational approac…
MindSpore Quantum: A User-Friendly, High-Performance, and AI-Compatible Quantum Computing Framework
Xusheng Xu, Jiangyu Cui, Zidong Cui +36
We introduce MindSpore Quantum, a pioneering hybrid quantum-classical framework with a primary focus on the design and implementation of noisy intermediate-scale quantum (NISQ) alg…
Quantum computation of conical intersections on a programmable superconducting quantum processor
Shoukuan Zhao, Diandong Tang, Xiaoxiao Xiao +7
Conical intersections (CIs) are pivotal in many photochemical processes. Traditional quantum chemistry methods, such as the state-average multi-configurational methods, face comput…