Quantum computational advantage using photons
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December 2020 |
The Determination of Energies and Wavefunctions with Full Electronic Correlation
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April 1969 |
Spinfree formulation of reduced density matrices, density cumulants and generalised normal ordering
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February 2010 |
Geminal-spanning orbitals make explicitly correlated reduced-scaling coupled-cluster methods robust, yet simple
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August 2014 |
An explicitly correlated approach to basis set incompleteness in full configuration interaction quantum Monte Carlo
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October 2012 |
Møller-plesset calculations taking care of the correlation CUSP
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February 1987 |
Neue Berechnung der Energie des Heliums im Grundzustande, sowie des tiefsten Terms von Ortho-Helium
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May 1929 |
Unitary Partitioning Approach to the Measurement Problem in the Variational Quantum Eigensolver Method
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November 2019 |
Alternative formulation of the matrix elements in MP2-R12 theory
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January 2005 |
Variational transcorrelated method
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October 2010 |
Is the Trotterized UCCSD Ansatz Chemically Well-Defined?
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November 2019 |
A variational eigenvalue solver on a photonic quantum processor
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July 2014 |
SF-[2]R12: A spin-adapted explicitly correlated method applicable to arbitrary electronic states
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December 2011 |
A simple F12 geminal correction in multi-reference perturbation theory
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October 2007 |
Cumulant expansion of the reduced density matrices
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February 1999 |
Qulacs: a fast and versatile quantum circuit simulator for research purpose
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October 2021 |
P si4 1.4: Open-source software for high-throughput quantum chemistry
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May 2020 |
Perturbation—Variation Approach to Optical Rotatory Power
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July 1966 |
R12 methods in explicitly correlated molecular electronic structure theory
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July 2006 |
Generalized Unitary Coupled Cluster Wave functions for Quantum Computation
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November 2018 |
Quantum Computing in the NISQ era and beyond
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August 2018 |
Initiation of explicitly correlated Slater-type geminal theory
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November 2004 |
Analysis of the errors in explicitly correlated electronic structure theory
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January 2005 |
Perspective: Explicitly correlated electronic structure theory for complex systems
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February 2017 |
Removal of Electron—Electron Poles from Many‐Electron Hamiltonians
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December 1963 |
Explicit correlation factors
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September 2017 |
On the order problem in construction of unitary operators for the variational quantum eigensolver
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January 2020 |
Hartree-Fock on a superconducting qubit quantum computer
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August 2020 |
Strategies for quantum computing molecular energies using the unitary coupled cluster ansatz
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October 2018 |
On Singularities in Eigenfunctions
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November 1965 |
Variational ansatz-based quantum simulation of imaginary time evolution
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September 2019 |
A quantum computing view on unitary coupled cluster theory
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January 2022 |
Studies in Perturbation Theory. IV. Solution of Eigenvalue Problem by Projection Operator Formalism
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September 1962 |
Efficient quantum measurement of Pauli operators in the presence of finite sampling error
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January 2021 |
Wave functions with terms linear in the interelectronic coordinates to take care of the correlation cusp. I. General theory
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February 1991 |
Noisy intermediate-scale quantum algorithms
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February 2022 |
Rates of convergence of the partial‐wave expansions of atomic correlation energies
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March 1992 |
Wave functions with terms linear in the interelectronic coordinates to take care of the correlation cusp. III. Second‐order Mo/ller–Plesset (MP2‐R12) calculations on molecules of first row atoms
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February 1991 |
Improving on the resolution of the identity in linear R12 ab initio theories
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September 2004 |
Quantum computational chemistry
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March 2020 |
Local explicitly correlated second-order Møller–Plesset perturbation theory with pair natural orbitals
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August 2011 |
Explicitly Correlated R12/F12 Methods for Electronic Structure
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December 2011 |
Optimized low-depth quantum circuits for molecular electronic structure using a separable-pair approximation
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March 2022 |
On the eigenfunctions of many-particle systems in quantum mechanics
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January 1957 |
Measurement optimization in the variational quantum eigensolver using a minimum clique cover
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March 2020 |
Rates of convergence and error estimation formulas for the Rayleigh–Ritz variational method
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August 1985 |
Application of fermionic marginal constraints to hybrid quantum algorithms
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May 2018 |
Efficient and noise resilient measurements for quantum chemistry on near-term quantum computers
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February 2021 |
A feasible approach for automatically differentiable unitary coupled-cluster on quantum computers
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January 2021 |
Normal order and extended Wick theorem for a multiconfiguration reference wave function
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July 1997 |
Variational formulation of perturbative explicitly-correlated coupled-cluster methods
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January 2008 |
Decoding quantum errors with subspace expansions
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January 2020 |
Quantum Theory of Many-Particle Systems. I. Physical Interpretations by Means of Density Matrices, Natural Spin-Orbitals, and Convergence Problems in the Method of Configurational Interaction
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March 1955 |
A Condition to Remove the Indeterminacy in Interelectronic Correlation Functions
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March 1969 |
Explicitly correlated second order perturbation theory: Introduction of a rational generator and numerical quadratures
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January 2004 |
The theory of variational hybrid quantum-classical algorithms
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February 2016 |
Hybrid quantum-classical hierarchy for mitigation of decoherence and determination of excited states
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April 2017 |
Assessment of Perturbative Explicitly Correlated Methods for Prototypes of Multiconfiguration Electronic Structure
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November 2013 |
SciNet: Lessons Learned from Building a Power-efficient Top-20 System and Data Centre
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November 2010 |
Universal perturbative explicitly correlated basis set incompleteness correction
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November 2009 |
Quantum supremacy using a programmable superconducting processor
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October 2019 |
Massively Parallel Implementation of Explicitly Correlated Coupled-Cluster Singles and Doubles Using TiledArray Framework
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December 2016 |
Chemistry on Quantum Computers with Virtual Quantum Subspace Expansion
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August 2020 |
Study of some interelectronic properties in helium-like atoms
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March 1992 |
Qubit Coupled Cluster Method: A Systematic Approach to Quantum Chemistry on a Quantum Computer
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November 2018 |
Reducing Qubit Requirements while Maintaining Numerical Precision for the Variational Quantum Eigensolver: A Basis-Set-Free Approach
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January 2021 |
r 12-Dependent terms in the wave function as closed sums of partial wave amplitudes for large l
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December 1985 |
OpenFermion: the electronic structure package for quantum computers
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June 2020 |
Spin-Free [2] R12 Basis Set Incompleteness Correction to the Local Multireference Configuration Interaction and the Local Multireference Average Coupled Pair Functional Methods
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June 2016 |
Assessment of multireference approaches to explicitly correlated full configuration interaction quantum Monte Carlo
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August 2016 |
Direct determination of optimal pair-natural orbitals in a real-space representation: The second-order Moller–Plesset energy
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February 2020 |
Quantum simulation of electronic structure with a transcorrelated Hamiltonian: improved accuracy with a smaller footprint on the quantum computer
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January 2020 |
TEQUILA: a platform for rapid development of quantum algorithms
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March 2021 |
Mutual information-assisted adaptive variational quantum eigensolver
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July 2021 |
Canonical transcorrelated theory with projected Slater-type geminals
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February 2012 |
Regularizing the molecular potential in electronic structure calculations. I. SCF methods
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November 2014 |
The principle-quantum-number (and the radial-quantum-number) expansion of the correlation energy of two-electron atoms
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January 2008 |
Hybrid Quantum-Classical Algorithms and Quantum Error Mitigation
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March 2021 |
Discovery of a General Method of Solving the Schrödinger and Dirac Equations That Opens a Way to Accurately Predictive Quantum Chemistry
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June 2012 |
Quantum Chemistry in the Age of Quantum Computing
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August 2019 |
SparseMaps—A systematic infrastructure for reduced-scaling electronic structure methods. IV. Linear-scaling second-order explicitly correlated energy with pair natural orbitals
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April 2016 |
Perturbative correction for the basis set incompleteness error of complete-active-space self-consistent field
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November 2010 |
An adaptive variational algorithm for exact molecular simulations on a quantum computer
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July 2019 |