Key papers

• Roadmap for Molecular Benchmarks in Nonadiabatic Dynamics (2025)
  L\'eon E. Cigrang et al.
  8.65
• Optimal Symbolic Construction of Matrix Product Operators and Tree Tensor Network Operators (2025)
  Hazar \c{C}ak{\i}r et al.
  6.96
• The Python Simulations of Chemistry Framework: 10 years of an open-source quantum chemistry project (2026)
  Qiming Sun et al.
  6.29
• An Efficient scaled opposite-spin MP2 method for periodic systems (2025)
  Idan Haritan et al.
  5.59
• Density-Functional Tight Binding Meets Maxwell: Unraveling the Mysteries of (Strong) Light-Matter Coupling Efficiently (2025)
  Dominik Sidler et al.
  5.15
• Learning quantum ground states in the space of measurement outcomes (2026)
  Kartiek Agarwal
  4.90
• Partitioned Hybrid Quantum Fourier Neural Operators for Scientific Quantum Machine Learning (2025)
  Paolo Marcandelli et al.
  4.53
• Designing Maintainable Hybrid Generative Systems: A Quantum-Inspired Approach to Automated Music Harmony Generation (2026)
  Josef Pavlicek
  4.39
• Simulating neural network criticality and resource dynamics with Rydberg gases (2026)
  Patrick Mischke et al.
  4.39
• Information Compression at Criticality (2026)
  Simon Jiricek et al.
  4.39
• Collective modes in non-Hermitian fermionic superfluids (2026)
  Gabriel Angelo V. Vila et al.
  4.39
• Sixteen-State Energy Mapping for First-Principles Four-Spin Ring Exchange: Validation on $La_2CuO_4$ and $SrFeO_2$ (2026)
  Xavier Rocquefelte et al.
  4.39
• Boundary quenches in (1+1)-dimensional conformal field theory (2026)
  Michele Fossati et al.
  4.39
• Dynamical correlation functions of extensive charges after global quantum quenches (2026)
  Riccardo Travaglino et al.
  4.39
• Constrained free energy minimization for the design of thermal states and stabilizer thermodynamic systems (2025)
  Michele Minervini et al.
  3.92
• Generative flow-based warm start of the variational quantum eigensolver (2025)
  Hang Zou and Martin Rahm and Anton Frisk Kockum and Simon Olsson
  3.86
• Accurate neural quantum states for interacting lattice bosons (2024)
  Zakari Denis and Giuseppe Carleo
  3.75
• Exact quantum dynamics of methanol: full-dimensional ab initio potential energy surface of spectroscopic quality and variational vibrational states (2025)
  Ayaki Sunaga and Tibor Gy\H{o}ri and G\'abor Czak\'o and Edit Matyus
  3.75
• Nishimori Threshold Estimation for Bayesian Inference and $\mathbb{Z}_q$ Surface Code Decoding (2026)
  Rohit Mukherjee et al.
  3.51
• Simulating the Dicke Model on Qubit-Based and hybrid Qubit-Boson-Based Quantum Computers (2026)
  Aravind P. Babu et al.
  3.51
• Quantum Reservoir Computing: Recent Advances and Future Directions (2026)
  Shehbaz Tariq et al.
  3.51
• Dismantling the Stoquastic Dichotomy (2026)
  Armen Karakashian et al.
  3.51
• Spontaneous optical emission of a randomly oriented chiral quantum source (2026)
  Mikael P. Backlund
  3.51
• Efficient quantum transport in disordered Floquet networks (2026)
  Hl\'er Kristj\'ansson et al.
  3.51
• Absence of poor local minima in matrix product states (2026)
  Hao-Kai Zhang et al.
  3.45
• Observation of associative-memory retrieval and spin-glass phases on a photonic quantum simulator (2026)
  Taira Giordani et al.
  3.39
• TENSO: Software Package for Numerically Exact Open Quantum Dynamics Based on Efficient Tree Tensor Network Decomposition of the Hierarchical Equations of Motion (2026)
  Juan C. Rodriguez Betancourt and Michelle C. Anderson and Luchang Niu and Xinxian Chen and Ignacio Franco
  3.28
• Error-Mitigation Enabled Multicomponent Quantum Simulations Beyond the Born-Oppenheimer Approximation (2025)
  Delmar G. A. Cabral et al.
  3.15
• Trapped-Ion Quantum Simulation of Electron Transfer Models with Tunable Dissipation (2024)
  Visal So et al.
  3.14
• Moments-based quantum computation of the electric dipole moment of molecular systems (2025)
  Michael A. Jones et al.
  3.04
• Alz-QNet: A Quantum Regression Network for Studying Alzheimer's Gene Interactions (2025)
  Debanjan Konar and Neerav Sreekumar and Richard Jiang and Vaneet Aggarwal
  2.99
• Auxiliary Field Quantum Monte Carlo for Electron-Photon Correlation (2025)
  Braden M. Weight and Yu Zhang
  2.82
• Compactifying Electronic Wavefunctions I: Error-Mitigated Transcorrelated DMRG (2025)
  Bruna G. M. Ara\'ujo et al.
  2.71
• QuantumDNA: A Python Package for Analyzing Quantum Charge Dynamics in DNA and Exploring Its Biological Relevance (2025)
  Dennis Herb et al.
  2.65
• A Roadmap for Simulating Chemical Dynamics on a Parametrically Driven Bosonic Quantum Device (2024)
  Delmar G. A. Cabral and Pouya Khazaei and Brandon C. Allen and Pablo E. Videla and Max Sch\"afer and Rodrigo G. Corti\~nas and Alejandro Cros Carrillo de Albornoz and Jorge Ch\'avez-Carlos and Lea F. Santos and Eitan Geva and Victor S. Batista
  2.43
• Learning local equivariant representations for quantum operators (2024)
  Zhanghao Zhouyin and Zixi Gan and MingKang Liu and Shishir Kumar Pandey and Linfeng Zhang and Qiangqiang Gu
  2.32
• Property-guided Inverse Design of Metal-Organic Frameworks Using Quantum Natural Language Processing (2024)
  Shinyoung Kang et al.
  2.21
• Thermodynamics of Quantum Reservoir Computing (2026)
  Lixiang Ding et al.
  2.00
• A Quantum Framework for Protein Binding‐Site Structure Prediction on Utility‐Level Quantum Processors (Adv. Sci. 12/2026) (2026)
  Yuqi Zhang et al.
  1.94
• Adaptive H-EFT-VA: A Provably Safe Trajectory Through the Trainability-Expressibility Landscape of Variational Quantum Algorithms (2026)
  Eyad I. B. Hamid
  1.83
• Split-Evolution Quantum Phase Estimation for Particle-Conserving Hamiltonians (2026)
  Megan Cerys Rowe et al.
  1.83
• Discovering quantum phenomena with Interpretable Machine Learning (2026)
  Paulin de Schoulepnikoff et al.
  1.83
• MQED-QD: An Open-Source Package for Quantum Dynamics Simulation in Complex Dielectric Environments (2026)
  Guangming Liu et al.
  1.78
• Classically Driven Hybrid Quantum Algorithms with Sequential Givens Rotations for Reduced Measurement Cost (2026)
  Benjamin Mokhtar and Noboru Inoue and Takashi Tsuchimochi
  1.78
• Raman relaxation in Yb(III) molecular qubits: non-trivial correlations between spin-phonon coupling and molecular structure (2026)
  Giacomo Sansone et al.
  1.78
• Hunting for quantum advantage in electronic structure calculations is a highly non-trivial task (2026)
  \"Ors Legeza et al.
  1.78
• Investigating Quantum Circuit Designs Using Neuro-Evolution (2026)
  Devroop Kar et al.
  1.72
• Near-frustration-free electronic structure Hamiltonian representations and lower bound certificates (2026)
  Nicholas C. Rubin et al.
  1.72
• Trainability-Oriented Hybrid Quantum Regression via Geometric Preconditioning and Curriculum Optimization (2026)
  Qingyu Meng and Yangshuai Wang
  1.67
• Orthogonally Constrained CASSCF Framework: Newton-Raphson Orbital Optimization and Nuclear Gradients (2026)
  Loris Delafosse et al.
  1.67
• Programmable Switching of Molecular Transitions via Plasmonic Toroidal Nanoantennae (2025)
  Arda Gulucu and Emre Ozan Polat
  1.61
• MaxwellLink: A unified framework for self-consistent light-matter simulations (2025)
  Xinwei Ji et al.
  1.61
• Capturing reduced-order quantum many-body dynamics out of equilibrium via neural ordinary differential equations (2025)
  Patrick Egenlauf et al.
  1.61
• Tree Tensor Networks Methods for Efficient Calculation of Molecular Vibrational Spectra (2025)
  Shuo Sun et al.
  1.61
• Encoding electronic ground-state information with variational even-tempered basis sets (2025)
  Weishi Wang et al.
  1.56
• Fusion of classical and quantum kernels enables accurate and robust two-sample tests (2025)
  Yu Terada et al.
  1.56
• Rapid ground state energy estimation with a Sparse Pauli Dynamics-enabled Variational Double Bracket Flow (2025)
  Chinmay Shrikhande et al.
  1.56
• Integrated Software/Hardware Execution Models for High-Accuracy Methods in Chemistry (2025)
  Nicholas Bauman et al.
  1.50
• Magnetometry with Broadband Microwave Fields in Nitrogen-Vacancy Centers in Diamond (2025)
  Arezoo Afshar et al.
  1.50
• Interpolative separable density fitting on adaptive real space grids (2025)
  Hai Zhu et al.
  1.50