Joonho Lee
Academic
Totals
Coverage
Top venues 22 venues
The 8 holding the most of these works; 14 more hold at least one.
Publications per year
Works this academic published in each year, by the year each work appeared; an undated work is in no year, and a work two colleagues wrote counts for each of them. The kind, works and year filters decide which works are here at all.
Citations per year
Citations received in each year, from this academic’s verified Scholar profile, which counts every citation to everything they ever wrote: no publication filter reaches this line - not the kinds, not the works switch, not the year window on publication - and no journal weight either. It is a profile total, so it does not match the works listed below.
Publications 92 works
Every work these filters select, most cited first and the works with no count at the end: a work nobody has a figure for is unknown, never a zero to be ranked among the works that have one, and it prints an em dash. Each figure is that work’s own citations - Scholar’s count where there is one, else OpenAlex’s - and is not weighted.
| Year | Title | Venue | Kind | Citations |
|---|---|---|---|---|
| 2021 | Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package | The Journal of Chemical Physics | article | 1,577 |
| 2023 | Suppressing quantum errors by scaling a surface code logical qubit | Nature | article | 1,362 |
| 2019 | Generalized unitary coupled cluster wave functions for quantum computation | Journal of Chemical Theory and Computation | article | 625 |
| 2021 | Even more efficient quantum computations of chemistry through tensor hypercontraction | PRX Quantum | article | 576 |
| 2022 | Time-crystalline eigenstate order on a quantum processor | Nature | article | 513 |
| 2023 | Evaluating the evidence for exponential quantum advantage in ground-state quantum chemistry | Nature Communications | article | 468 |
| 2016 | A deterministic alternative to the full configuration interaction quantum Monte Carlo method | The Journal of Chemical Physics | article | 443 |
| 2021 | Virtual distillation for quantum error mitigation | Physical Review X | article | 388 |
| 2025 | Quantum error correction below the surface code threshold | Nature | article | 382 |
| 2024 | Phase transitions in random circuit sampling | Nature | article | 365 |
| 2022 | Unbiasing fermionic quantum Monte Carlo with a quantum computer | Nature | article | 294 |
| 2020 | A non-orthogonal variational quantum eigensolver | New Journal of Physics | article | 238 |
| 2023 | Measurement-induced entanglement and teleportation on a noisy quantum processor | Nature | article | 221 |
| 2020 | QMCPACK: Advances in the development, efficiency, and application of auxiliary field and real-space variational and diffusion quantum Monte Carlo | The Journal of Chemical Physics | article | 198 |
| 2024 | Stable quantum-correlated many-body states through engineered dissipation | Science | article | 192 |
| 2023 | Matchgate shadows for fermionic quantum simulation | — | article | 184 |
| 2022 | Reliably assessing the electronic structure of cytochrome P450 on today’s classical computers and tomorrow’s quantum computers | Proceedings of the National Academy of Sciences | article | 183 |
| 2025 | Thermalization and criticality on an analogue–digital quantum simulator | Nature | article | 173 |
| 2018 | Regularized orbital-optimized second-order Møller–Plesset perturbation theory: A reliable fifth-order-scaling electron correlation model with orbital energy de… | Journal of Chemical Theory and Computation | article | 162 |
| 2023 | Non-Abelian braiding of graph vertices in a superconducting processor | Nature | article | 160 |
| 2024 | Dynamics of magnetization at infinite temperature in a Heisenberg spin chain | Science | article | 158 |
| 2023 | Purification-based quantum error mitigation of pair-correlated electron simulations | Nature Physics | article | 136 |
| 2022 | Noise-resilient edge modes on a chain of superconducting qubits | Science | article | 136 |
| 2025 | Observation of constructive interference at the edge of quantum ergodicity | Nature | article | 114 |
| 2021 | Regularized second order Møller-Plesset theory: A more accurate alternative to conventional MP2 for noncovalent interactions and transition metal thermochemist… | The Journal of Physical Chemistry Letters | article | 114 |
| 2023 | Data-efficient machine learning potentials from transfer learning of periodic correlated electronic structure methods: Liquid water at AFQMC, CCSD, and CCSD (T… | Journal of Chemical Theory and Computation | article | 112 |
| 2022 | Formation of robust bound states of interacting microwave photons | Nature | article | 107 |
| 2022 | Twenty years of auxiliary-field quantum Monte Carlo in quantum chemistry: An overview and assessment on main group chemistry and bond-breaking | Journal of Chemical Theory and Computation | article | 106 |
| 2019 | Excited states via coupled cluster theory without equation-of-motion methods: Seeking higher roots with application to doubly excited states and double core ho… | The Journal of Chemical Physics | article | 106 |
| 2020 | Systematically improvable tensor hypercontraction: Interpolative separable density-fitting for molecules applied to exact exchange, second-and third-order Møll… | Journal of Chemical Theory and Computation | article | 101 |
| 2021 | Revealing the Nature of Electron Correlation in Transition Metal Complexes with Symmetry-Breaking and Chemical Intuition | The Journal of Chemical Physics | article | 97 |
| 2022 | Efficient quantum computation of molecular forces and other energy gradients | Physical Review Research | article | 93 |
| 2019 | Distinguishing artificial and essential symmetry breaking in a single determinant: approach and application to the C60, C36, and C20 fullerenes | Physical Chemistry Chemical Physics | article | 88 |
| 2017 | Coupled-cluster valence-bond singles and doubles for strongly correlated systems: Block-tensor based implementation and application to oligoacenes | Journal of Chemical Theory and Computation | article | 70 |
| 2023 | Fault-tolerant quantum simulation of materials using Bloch orbitals | PRX Quantum | article | 67 |
| 2021 | A phaseless auxiliary-field quantum Monte Carlo perspective on the uniform electron gas at finite temperatures: Issues, observations, and benchmark study | The Journal of Chemical Physics | article | 67 |
| 2023 | Microscopic theory of multimode polariton dispersion in multilayered materials | Nano Letters | article | 65 |
| 2024 | Quantum computation of stopping power for inertial fusion target design | Proceedings of the National Academy of Sciences | article | 64 |
| 2023 | Quantum simulation of exact electron dynamics can be more efficient than classical mean-field methods | Nature Communications | article | 64 |
| 2019 | Two single-reference approaches to singlet biradicaloid problems: Complex, restricted orbitals and approximate spin-projection combined with regularized orbita… | The Journal of Chemical Physics | article | 63 |
| 2020 | Utilizing Essential Symmetry Breaking in Auxiliary-Field Quantum Monte Carlo: Application to the Spin Gaps of the C36 Fullerene and an Iron Porphyrin Model … | Journal of Chemical Theory and Computation | article | 62 |
| 2019 | Third-order Møller–Plesset perturbation theory made useful? Choice of orbitals and scaling greatly improves accuracy for thermochemistry, kinetics, and intermo… | The Journal of Physical Chemistry Letters | article | 62 |
| 2022 | Selected configuration interaction wave functions in phaseless auxiliary field quantum Monte Carlo | The Journal of Chemical Physics | article | 60 |
| 2021 | Polishing the gold standard: The role of orbital choice in CCSD (T) vibrational frequency prediction | Journal of Chemical Theory and Computation | article | 54 |
| 2023 | ipie: a python-based auxiliary-field quantum Monte Carlo program with flexibility and efficiency on CPUs and GPUs | Journal of Chemical Theory and Computation | article | 46 |
| 2021 | A non-perturbative pairwise-additive analysis of charge transfer contributions to intermolecular interaction energies | Physical Chemistry Chemical Physics | article | 46 |
| 2020 | The performance of phaseless auxiliary-field quantum Monte Carlo on the ground state electronic energy of benzene | The Journal of Chemical Physics | article | 42 |
| 2022 | Accurate core excitation and ionization energies from a state-specific coupled-cluster singles and doubles approach | Physical Chemistry Chemical Physics | article | 41 |
| 2016 | Halogen−π Interactions between Benzene and X2/CX4 (X = Cl, Br): Assessment of Various Density Functionals with Respect to CCSD(T) | The Journal of Physical Chemistry A | article | 41 |
| 2021 | Exploring the Limits of Second-and Third-Order Møller-Plesset Perturbation Theory for Non-Covalent Interactions: Revisiting MP2. 5 and Assessing the Importance… | Journal of Chemical Theory and Computation | article | 38 |
| 2019 | Kohn-Sham density functional theory with complex, spin-restricted orbitals: Accessing a new class of densities without the symmetry dilemma | Physical Review Letters | article | 38 |
| 2019 | Making many-body interactions nearly pairwise additive: The polarized many-body expansion approach | The Journal of Chemical Physics | article | 36 |
| 2024 | Unified framework for open quantum dynamics with memory | Nature Communications | article | 35 |
| 2021 | Approaching the basis set limit in Gaussian-orbital-based periodic calculations with transferability: Performance of pure density functionals for simple semico… | The Journal of Chemical Physics | article | 33 |
| 2020 | Stochastic resolution-of-the-identity auxiliary-field quantum Monte Carlo: Scaling reduction without overhead | The Journal of Chemical Physics | article | 33 |
| 2022 | Faster exact exchange for solids via occ-RI-K: Application to combinatorially optimized range-separated hybrid functionals for simple solids with pseudopotenti… | Journal of Chemical Theory and Computation | article | 32 |
| 2025 | Unbiasing fermionic auxiliary-field quantum Monte Carlo with matrix product state trial wavefunctions | Physical Review Research | article | 30 |
| 2022 | Compressing many-body fermion operators under unitary constraints | Journal of Chemical Theory and Computation | article | 30 |
| 2021 | What the foundations of quantum computer science teach us about chemistry | The Journal of Chemical Physics | article | 30 |
| 2014 | Limit of metastability for liquid and vapor phases of water | Physical Review Letters | article | 29 |
| 2022 | Revisiting the orbital energy-dependent regularization of orbital-optimized second-order Møller–Plesset theory | Journal of Chemical Theory and Computation | article | 28 |
| 2023 | Even faster exact exchange for solids via tensor hypercontraction | Journal of Chemical Theory and Computation | article | 27 |
| 2021 | Constrained-path auxiliary-field quantum Monte Carlo for coupled electrons and phonons | Physical Review B | article | 27 |
| 2024 | Quantum simulation of realistic materials in first quantization using non-local pseudopotentials | — | article | 25 |
| 2019 | An auxiliary-Field quantum Monte Carlo perspective on the ground state of the dense uniform electron gas: An investigation with Hartree-Fock trial wavefunctions | The Journal of Chemical Physics | article | 25 |
| 2025 | Walking through Hilbert space with quantum computers | Chemical Reviews | article | 22 |
| 2023 | Response properties in phaseless auxiliary field quantum Monte Carlo | The Journal of Chemical Physics | article | 22 |
| 2021 | Spectral functions from auxiliary-field quantum Monte Carlo without analytic continuation: The extended Koopmans’ theorem approach | Journal of Chemical Theory and Computation | article | 20 |
| 2022 | A Localized-Orbital Energy Evaluation for Auxiliary-Field Quantum Monte Carlo | Journal of Chemical Theory and Computation | article | 18 |
| 2022 | Near-exact nuclear gradients of complete active space self-consistent field wave functions | The Journal of Chemical Physics | article | 18 |
| 2018 | Open-shell coupled-cluster valence-bond theory augmented with an independent amplitude approximation for three-pair correlations: Application to a model oxygen… | The Journal of Chemical Physics | article | 18 |
| 2019 | Energy Decomposition Analysis for Interactions of Radicals: Theory and Implementation at the MP2 Level with Application to Hydration of Halogenated Benzene Cat… | The Journal of Physical Chemistry A | article | 17 |
| 2011 | Host–guest chemistry in the gas phase: complex formation with 18-crown-6 enhances helicity of alanine-based peptides | The Journal of Physical Chemistry A | article | 17 |
| 2024 | Improved modularity and new features in ipie: Toward even larger AFQMC calculations on CPUs and GPUs at zero and finite temperatures | The Journal of Chemical Physics | article | 16 |
| 2023 | Competing generalized Wigner crystal states in moiré heterostructures | Physical Review B | article | 16 |
| 2017 | Adsorption of carbon tetrahalides on coronene and graphene | The Journal of Physical Chemistry C | article | 16 |
| 2025 | Gaussian-based periodic grand canonical density functional theory with implicit solvation for computational electrochemistry | Journal of Chemical Theory and Computation | article | 12 |
| 2025 | Regularized Perturbation Theory for Ab Initio Solids | The Journal of Physical Chemistry Letters | article | 10 |
| 2025 | Structure and dynamics of electron-phonon coupled systems using neural quantum states | Physical Review B | article | 10 |
| 2025 | Observation of disorder-free localization and efficient disorder averaging on a quantum processor | — | article | 10 |
| 2025 | Condensed‐Phase Quantum Chemistry | Wiley Interdisciplinary Reviews Computational Molecular Sci… | book | 9 |
| 2024 | Stochastic resolution of identity to CC2 for large systems: excited state properties | Journal of Chemical Theory and Computation | article | 9 |
| 2025 | On the discretization error of the discrete generalized quantum master equation | The Journal of Chemical Physics | article | 7 |
| 2025 | Ab initio polaron wave functions | Physical Review B | article | 6 |
| 2024 | Stochastic resolution of identity to CC2 for large systems: Ground state and triplet excitation energy calculations | The Journal of Physical Chemistry A | article | 6 |
| 2021 | Exploring Spin Symmetry-Breaking Effects for Static Field Ionization of Atoms: Is There an Analog to the Coulson-Fischer Point in Bond Dissociation? | The Journal of Chemical Physics | article | 6 |
| 2026 | Resolving the body-order paradox of machine learning interatomic potentials | The Journal of Chemical Physics | article | 5 |
| 2022 | Time-dependent second-order green’s function theory for neutral excitations | Journal of Chemical Theory and Computation | article | 4 |
| 2026 | Efficient all-electron periodic Fourier-transformed Coulomb method | The Journal of Chemical Physics | article | 3 |
| 2025 | How to correct Ehrenfest nonadiabatic dynamics in open quantum systems: Ehrenfest plus random force (E+ σ) dynamics | The Journal of Chemical Physics | article | 3 |
| 2021 | Molecular magnetisabilities computed via finite fields: assessing alternatives to MP2 and revisiting magnetic exaltations in aromatic and antiaromatic species | Molecular Physics | article | 3 |
| 2018 | Molecular Mechanics Simulations and Improved Tight-Binding Hamiltonians for Artificial Light Harvesting Systems: Predicting Geometric Distributions, Disorder,… | The Journal of Physical Chemistry B | article | 3 |