Research graph
References from Dissipative Quantum Algorithms for Excited-State Quantum Chemistry. Local targets link to admitted publications; unresolved targets remain external evidence.
10.1002/9781119417774
10.1002/9781119417774 · 2020 · External reference
Introduction: light harvesting
10.1021/acs.chemrev.6b00826 · 2017 · External reference
Visible light photoredox catalysis with transition metal complexes: applications in organic synthesis
10.1021/cr300503r · 2013 · External reference
Unresolved reference
2007 · External reference
Variational excitations in real solids: Optical gaps and insights into many-body perturbation theory
10.1103/physrevlett.123.036402 · 2019 · External reference
Accurate computation of quantum excited states with neural networks
10.1126/science.adn0137 · 2024 · External reference
Quantum algorithm providing exponential speed increase for finding eigenvalues and eigenvectors
10.1103/physrevlett.83.5162 · 1999 · External reference
Unresolved reference
2010 · External reference
Evaluating the evidence for exponential quantum advantage in ground-state quantum chemistry
10.1038/s41467-023-37587-6 · 2023 · External reference
10.1090/gsm/047
10.1090/gsm/047 · 2002 · External reference
The Complexity of the Local Hamiltonian Problem
10.1137/s0097539704445226 · 2006 · External reference
The power of quantum systems on a line
10.1007/s00220-008-0710-3 · 2009 · External reference
Hybrid Quantum-Classical Hierarchy for Mitigation of Decoherence and Determination of Excited States
10.1103/physreva.95.042308 · 2017 · External reference
A Multireference Quantum Krylov Algorithm for Strongly Correlated Electrons
10.1021/acs.jctc.9b01125 · 2020 · External reference
Quantum Filter Diagonalization with Compressed Double-Factorized Hamiltonians
10.1103/prxquantum.2.040352 · 2021 · External reference
Quantum Krylov subspace algorithms for ground- and excited-state energy estimation
10.1103/physreva.105.022417 · 2022 · External reference
A theory of quantum subspace diagonalization
10.1137/21m145954x · 2022 · External reference
Quantum-Selected Configuration Interaction: Classical Diagonalization of Hamiltonians in Subspaces Selected by Quantum Computers
10.1103/dmn4-snfx · 2026 · External reference
Quantum Eigenvalue Estimation via Time Series Analysis
10.1088/1367-2630/ab5c60 · 2019 · External reference
Quantum phase estimation of multiple eigenvalues for small-scale (noisy) experiments
10.1088/1367-2630/aafb8e · 2019 · External reference
Heisenberg-limited ground state energy estimation for early fault-tolerant quantum computers
10.1103/prxquantum.3.010318 · 2022 · External reference
Even shorter quantum circuit for phase estimation on early fault-tolerant quantum computers with applications to ground-state energy estimation
10.1103/prxquantum.4.020331 · 2023 · External reference
Quantum Multiple Eigenvalue Gaussian Filtered Search: An Efficient and Versatile Quantum Phase Estimation Method
10.22331/q-2024-10-02-1487 · 2024 · External reference
Preparation of entangled states by quantum Markov processes
10.1103/physreva.78.042307 · 2008 · External reference
Quantum computation and quantum-state engineering driven by dissipation
10.1038/nphys1342 · 2009 · External reference
Dissipative preparation of many-body quantum states: Toward practical quantum advantage
10.1063/5.0283315 · 2025 · External reference
The variational quantum eigensolver: a review of methods and best practices
10.1016/j.physrep.2022.08.003 · 2022 · External reference
Unresolved reference
External reference
Variational ansatz-based quantum simulation of imaginary time evolution
10.1038/s41534-019-0187-2 · 2019 · External reference
Measurement-induced steering of quantum systems
10.1103/physrevresearch.2.033347 · 2020 · External reference
Unresolved reference
External reference
Stable quantum-correlated many-body states through engineered dissipation
10.1126/science.adh9932 · 2024 · External reference
Thermal state preparation via rounding promises
10.22331/q-2023-10-10-1132 · 2023 · External reference
Efficient quantum thermal simulation
10.1038/s41586-025-09583-x · 2025 · External reference
Unresolved reference
External reference
Efficient Quantum Gibbs Samplers with Kubo–Martin–Schwinger Detailed Balance Condition
10.1007/s00220-025-05235-3 · 2025 · External reference
Single-ancilla ground state preparation via Lindbladians
10.1103/physrevresearch.6.033147 · 2024 · External reference
Dissipative ground state preparation in ab initio electronic structure theory
10.1038/s41534-025-01124-8 · 2025 · External reference
Rapid quantum ground state preparation via dissipative dynamics
10.1103/wzb3-dbg9 · 2026 · External reference
Efficient Quantum Gibbs Sampling with Local Circuits
10.1103/m5zb-z4nn · 2026 · External reference
Unresolved reference
External reference
Unresolved reference
External reference
Fixing detailed balance in ancilla-based dissipative state engineering
10.1103/physrevresearch.6.043229 · 2024 · External reference
Quantum dissipative search via Lindbladians
10.1103/physreva.111.042430 · 2025 · External reference
Programmable adiabatic demagnetization for systems with trivial and topological excitations
10.22331/q-2024-10-23-1505 · 2024 · External reference
Unresolved reference
External reference
Dynamic thermalization on noisy quantum hardware
10.1038/s42005-025-02011-6 · 2025 · External reference
Unresolved reference
External reference
Quasiparticle Cooling Algorithms for Quantum Many-Body State Preparation
10.1103/prxquantum.6.010361 · 2025 · External reference
Automated construction of molecular active spaces from atomic valence orbitals
10.1021/acs.jctc.7b00128 · 2017 · External reference
Constructing molecular π-orbital active spaces for multireference calculations of conjugated systems
10.1021/acs.jctc.8b01196 · 2019 · External reference
PySCF: the Python-based simulations of chemistry framework
10.1002/wcms.1340 · 2018 · External reference
Recent developments in the PySCF program package
10.1063/5.0006074 · 2020 · External reference
10.1038/s41534-026-01327-7
10.1038/s41534-026-01327-7 · External reference
The equation of motion coupled-cluster method. A systematic biorthogonal approach to molecular excitation energies, transition probabilities, and excited state properties
10.1063/1.464746 · 1993 · External reference
Equation-of-motion coupled-cluster methods for open-shell and electronically excited species: The hitchhiker’s guide to Fock space
10.1146/annurev.physchem.59.032607.093602 · 2008 · External reference
Unrestricted coupled cluster and Brueckner doubles variations of W1 theory
10.1021/ct900260g · 2009 · External reference
The active-space equation-of-motion coupled-cluster methods for excited electronic states: Full EOMCCSDt
10.1063/1.1378323 · 2001 · External reference
High-resolution study of electron-impact spectra at kinetic energies between 33 and 100 eV and scattering angles to 16°
10.1063/1.1668178 · 1968 · External reference
Laser flash photolysis of benzene. III. Sn ← S1 absorption of gaseous benzene
10.1063/1.440131 · 1980 · External reference
Electronic absorption spectrum of ferrocene
10.1063/1.1840547 · 1967 · External reference
Ionized and excited states of ferrocene: Symmetry adapted cluster-configuration-interaction study
10.1063/1.1504709 · 2002 · External reference
Excited states and electronic spectrum of ferrocene
10.1016/0009-2614(74)85146-8 · 1974 · External reference
Theoretical study of the valence π → π* excited states of polyacenes: Benzene and naphthalene
10.1063/1.471286 · 1996 · External reference
Multi-configuration time-dependent density-functional theory based on range separation
10.1063/1.4792199 · 2013 · External reference
Density-matrix based determination of low-energy model Hamiltonians from ab initio wavefunctions
10.1063/1.4927664 · 2015 · External reference
Downfolding from ab initio to interacting model Hamiltonians: comprehensive analysis and benchmarking of the DFT+ cRPA approach
10.1038/s41524-024-01314-6 · 2024 · External reference
Noneigenstate Ab Initio Density Matrix Downfolding for Constructing Model Hamiltonians in Quantum Chemistry
10.1021/acs.jctc.5c00663 · 2025 · External reference
Towards an accurate molecular orbital theory for excited states: the benzene molecule
10.1016/0009-2614(92)85419-b · 1992 · External reference
Electronic structure of metallocenes
10.1021/ja00744a011 · 1971 · External reference
Symmetry constraints and variational principles in diffusion quantum Monte Carlo calculations of excited-state energies
10.1103/physrevb.60.4558 · 1999 · External reference
Excited state calculations using phaseless auxiliary-field quantum Monte Carlo: Potential energy curves of low-lying C2 singlet states
10.1063/1.3077920 · 2009 · External reference
Symmetry in auxiliary-field quantum Monte Carlo calculations
10.1103/physrevb.88.125132 · 2013 · External reference
Unresolved reference
External reference
Electronic structure pseudopotential calculations of large (.apprx. 1000 atoms) Si quantum dots
10.1021/j100059a032 · 1994 · External reference
Solving Schrödinger’s equation around a desired energy: Application to silicon quantum dots
10.1063/1.466486 · 1994 · External reference
Folded spectrum VQE: A quantum computing method for the calculation of molecular excited states
10.1021/acs.jctc.3c01378 · 2024 · External reference
10.1145/3313276.3316366
10.1145/3313276.3316366 · External reference
Grand Unification of Quantum Algorithms
10.1103/prxquantum.2.040203 · 2021 · External reference
A quantum hamiltonian simulation benchmark
10.1038/s41534-022-00636-x · 2022 · External reference
Unresolved reference
External reference
Quantum Filtering and Analysis of Multiplicities in Eigenvalue Spectra
10.1103/jch7-734h · 2026 · External reference
Unresolved reference
External reference
10.1002/9781119417774
10.1002/9781119417774 · ExternalCitation · doi-reference
PySCF: the Python-based simulations of chemistry framework
10.1002/wcms.1340 · ExternalCitation · doi-reference
The power of quantum systems on a line
10.1007/s00220-008-0710-3 · ExternalCitation · doi-reference
Efficient Quantum Gibbs Samplers with Kubo–Martin–Schwinger Detailed Balance Condition
10.1007/s00220-025-05235-3 · ExternalCitation · doi-reference
Excited states and electronic spectrum of ferrocene
10.1016/0009-2614(74)85146-8 · ExternalCitation · doi-reference
Towards an accurate molecular orbital theory for excited states: the benzene molecule
10.1016/0009-2614(92)85419-b · ExternalCitation · doi-reference
The variational quantum eigensolver: a review of methods and best practices
10.1016/j.physrep.2022.08.003 · ExternalCitation · doi-reference
Introduction: light harvesting
10.1021/acs.chemrev.6b00826 · ExternalCitation · doi-reference
Folded spectrum VQE: A quantum computing method for the calculation of molecular excited states
10.1021/acs.jctc.3c01378 · ExternalCitation · doi-reference
Noneigenstate Ab Initio Density Matrix Downfolding for Constructing Model Hamiltonians in Quantum Chemistry
10.1021/acs.jctc.5c00663 · ExternalCitation · doi-reference
Automated construction of molecular active spaces from atomic valence orbitals
10.1021/acs.jctc.7b00128 · ExternalCitation · doi-reference
Constructing molecular π-orbital active spaces for multireference calculations of conjugated systems
10.1021/acs.jctc.8b01196 · ExternalCitation · doi-reference
A Multireference Quantum Krylov Algorithm for Strongly Correlated Electrons
10.1021/acs.jctc.9b01125 · ExternalCitation · doi-reference
Visible light photoredox catalysis with transition metal complexes: applications in organic synthesis
10.1021/cr300503r · ExternalCitation · doi-reference
Unrestricted coupled cluster and Brueckner doubles variations of W1 theory
10.1021/ct900260g · ExternalCitation · doi-reference
Electronic structure pseudopotential calculations of large (.apprx. 1000 atoms) Si quantum dots
10.1021/j100059a032 · ExternalCitation · doi-reference
Electronic structure of metallocenes
10.1021/ja00744a011 · ExternalCitation · doi-reference
Quantum computation and quantum-state engineering driven by dissipation
10.1038/nphys1342 · ExternalCitation · doi-reference
Evaluating the evidence for exponential quantum advantage in ground-state quantum chemistry
10.1038/s41467-023-37587-6 · ExternalCitation · doi-reference
Downfolding from ab initio to interacting model Hamiltonians: comprehensive analysis and benchmarking of the DFT+ cRPA approach
10.1038/s41524-024-01314-6 · ExternalCitation · doi-reference
Variational ansatz-based quantum simulation of imaginary time evolution
10.1038/s41534-019-0187-2 · ExternalCitation · doi-reference
A quantum hamiltonian simulation benchmark
10.1038/s41534-022-00636-x · ExternalCitation · doi-reference
Dissipative ground state preparation in ab initio electronic structure theory
10.1038/s41534-025-01124-8 · ExternalCitation · doi-reference
10.1038/s41534-026-01327-7
10.1038/s41534-026-01327-7 · ExternalCitation · doi-reference
Efficient quantum thermal simulation
10.1038/s41586-025-09583-x · ExternalCitation · doi-reference
Dynamic thermalization on noisy quantum hardware
10.1038/s42005-025-02011-6 · ExternalCitation · doi-reference
The active-space equation-of-motion coupled-cluster methods for excited electronic states: Full EOMCCSDt
10.1063/1.1378323 · ExternalCitation · doi-reference
Ionized and excited states of ferrocene: Symmetry adapted cluster-configuration-interaction study
10.1063/1.1504709 · ExternalCitation · doi-reference
High-resolution study of electron-impact spectra at kinetic energies between 33 and 100 eV and scattering angles to 16°
10.1063/1.1668178 · ExternalCitation · doi-reference
Electronic absorption spectrum of ferrocene
10.1063/1.1840547 · ExternalCitation · doi-reference
Excited state calculations using phaseless auxiliary-field quantum Monte Carlo: Potential energy curves of low-lying C2 singlet states
10.1063/1.3077920 · ExternalCitation · doi-reference
Laser flash photolysis of benzene. III. Sn ← S1 absorption of gaseous benzene
10.1063/1.440131 · ExternalCitation · doi-reference
The equation of motion coupled-cluster method. A systematic biorthogonal approach to molecular excitation energies, transition probabilities, and excited state properties
10.1063/1.464746 · ExternalCitation · doi-reference
Solving Schrödinger’s equation around a desired energy: Application to silicon quantum dots
10.1063/1.466486 · ExternalCitation · doi-reference
Theoretical study of the valence π → π* excited states of polyacenes: Benzene and naphthalene
10.1063/1.471286 · ExternalCitation · doi-reference
Multi-configuration time-dependent density-functional theory based on range separation
10.1063/1.4792199 · ExternalCitation · doi-reference
Density-matrix based determination of low-energy model Hamiltonians from ab initio wavefunctions
10.1063/1.4927664 · ExternalCitation · doi-reference
Recent developments in the PySCF program package
10.1063/5.0006074 · ExternalCitation · doi-reference
Dissipative preparation of many-body quantum states: Toward practical quantum advantage
10.1063/5.0283315 · ExternalCitation · doi-reference
Quantum phase estimation of multiple eigenvalues for small-scale (noisy) experiments
10.1088/1367-2630/aafb8e · ExternalCitation · doi-reference
Quantum Eigenvalue Estimation via Time Series Analysis
10.1088/1367-2630/ab5c60 · ExternalCitation · doi-reference
10.1090/gsm/047
10.1090/gsm/047 · ExternalCitation · doi-reference
Quantum-Selected Configuration Interaction: Classical Diagonalization of Hamiltonians in Subspaces Selected by Quantum Computers
10.1103/dmn4-snfx · ExternalCitation · doi-reference
Quantum Filtering and Analysis of Multiplicities in Eigenvalue Spectra
10.1103/jch7-734h · ExternalCitation · doi-reference
Efficient Quantum Gibbs Sampling with Local Circuits
10.1103/m5zb-z4nn · ExternalCitation · doi-reference
Quantum Krylov subspace algorithms for ground- and excited-state energy estimation
10.1103/physreva.105.022417 · ExternalCitation · doi-reference
Quantum dissipative search via Lindbladians
10.1103/physreva.111.042430 · ExternalCitation · doi-reference
Preparation of entangled states by quantum Markov processes
10.1103/physreva.78.042307 · ExternalCitation · doi-reference
Hybrid Quantum-Classical Hierarchy for Mitigation of Decoherence and Determination of Excited States
10.1103/physreva.95.042308 · ExternalCitation · doi-reference
Symmetry constraints and variational principles in diffusion quantum Monte Carlo calculations of excited-state energies
10.1103/physrevb.60.4558 · ExternalCitation · doi-reference
Symmetry in auxiliary-field quantum Monte Carlo calculations
10.1103/physrevb.88.125132 · ExternalCitation · doi-reference
Variational excitations in real solids: Optical gaps and insights into many-body perturbation theory
10.1103/physrevlett.123.036402 · ExternalCitation · doi-reference
Quantum algorithm providing exponential speed increase for finding eigenvalues and eigenvectors
10.1103/physrevlett.83.5162 · ExternalCitation · doi-reference
Measurement-induced steering of quantum systems
10.1103/physrevresearch.2.033347 · ExternalCitation · doi-reference
Single-ancilla ground state preparation via Lindbladians
10.1103/physrevresearch.6.033147 · ExternalCitation · doi-reference
Fixing detailed balance in ancilla-based dissipative state engineering
10.1103/physrevresearch.6.043229 · ExternalCitation · doi-reference
Grand Unification of Quantum Algorithms
10.1103/prxquantum.2.040203 · ExternalCitation · doi-reference
Quantum Filter Diagonalization with Compressed Double-Factorized Hamiltonians
10.1103/prxquantum.2.040352 · ExternalCitation · doi-reference
Heisenberg-limited ground state energy estimation for early fault-tolerant quantum computers
10.1103/prxquantum.3.010318 · ExternalCitation · doi-reference
Even shorter quantum circuit for phase estimation on early fault-tolerant quantum computers with applications to ground-state energy estimation
10.1103/prxquantum.4.020331 · ExternalCitation · doi-reference
Quasiparticle Cooling Algorithms for Quantum Many-Body State Preparation
10.1103/prxquantum.6.010361 · ExternalCitation · doi-reference
Rapid quantum ground state preparation via dissipative dynamics
10.1103/wzb3-dbg9 · ExternalCitation · doi-reference
Stable quantum-correlated many-body states through engineered dissipation
10.1126/science.adh9932 · ExternalCitation · doi-reference
Accurate computation of quantum excited states with neural networks
10.1126/science.adn0137 · ExternalCitation · doi-reference
A theory of quantum subspace diagonalization
10.1137/21m145954x · ExternalCitation · doi-reference
The Complexity of the Local Hamiltonian Problem
10.1137/s0097539704445226 · ExternalCitation · doi-reference
10.1145/3313276.3316366
10.1145/3313276.3316366 · ExternalCitation · doi-reference
Equation-of-motion coupled-cluster methods for open-shell and electronically excited species: The hitchhiker’s guide to Fock space
10.1146/annurev.physchem.59.032607.093602 · ExternalCitation · doi-reference
Thermal state preparation via rounding promises
10.22331/q-2023-10-10-1132 · ExternalCitation · doi-reference
Quantum Multiple Eigenvalue Gaussian Filtered Search: An Efficient and Versatile Quantum Phase Estimation Method
10.22331/q-2024-10-02-1487 · ExternalCitation · doi-reference
Programmable adiabatic demagnetization for systems with trivial and topological excitations
10.22331/q-2024-10-23-1505 · ExternalCitation · doi-reference
