Quantum computing applied to calculations of molecular energies: CH2 benchmark

Multireference Mukherjee’s coupled cluster method with triexcitations in the linked formulation: Efficient implementation and applications

(2010) Kiran Bhaskaran-Nair et al.   JOURNAL OF CHEMICAL PHYSICS

Towards quantum chemistry on a quantum computer

(2010) B. P. Lanyon et al.   Nature Chemistry

NMR Implementation of a Molecular Hydrogen Quantum Simulation with Adiabatic State Preparation

(2010) Jiangfeng Du et al.   PHYSICAL REVIEW LETTERS

Quantum algorithm for molecular properties and geometry optimization

(2009) Ivan Kassal et al.   JOURNAL OF CHEMICAL PHYSICS

Preparation of many-body states for quantum simulation

(2009) Nicholas J. Ward et al.   JOURNAL OF CHEMICAL PHYSICS

Simulated quantum computation of global minima

(2009) Jing Zhu et al.   MOLECULAR PHYSICS

Quantum Simulators

(2009) I. Buluta et al.   SCIENCE

Multireference Brillouin–Wigner coupled cluster method with singles, doubles, and triples: Efficient implementation and comparison with approximate approaches

(2008) Ondřej Demel et al.   JOURNAL OF CHEMICAL PHYSICS

Quantum algorithm for obtaining the energy spectrum of molecular systems

(2008) Hefeng Wang et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Polynomial-time quantum algorithm for the simulation of chemical dynamics

(2008) I. Kassal et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA