Emerging quantum computing algorithms for quantum chemistry

Digital quantum computers provide a computational framework for solving the Schrödinger equation variety of many-particle systems. Quantum computing algorithms simulation these systems have recently witnessed remarkable growth, notwithstanding limitations existing hardware, especially as tool electronic structure computations in molecules. In this review, we self-contained introduction to emerging Hamiltonian dynamics and eigenstates, with emphasis on their applications molecular Theoretical foundations implementation details method are discussed, strengths, limitations, recent advances presented. This article is categorized under: Computing > Algorithms Electronic Structure Theory Ab Initio Methods Development