OCTOBER 2, 2025 Journal Article Extending Badger’s Rule. I. The Relationship between Energy and Structure in Hydrogen Bonds ( Read More )
OCTOBER 2, 2025 Journal Article Projector-Based Quantum Embedding Study of Iron Complexes ( Read More )
SEPTEMBER 10, 2025 Journal Article An Early Investigation of the HHL Quantum Linear Solver for Scientific Applications ( Read More )
SEPTEMBER 5, 2025 Journal Article Quantum Simulation of Boson-Related Hamiltonians: Techniques, Effective Hamiltonian Construction, and Error Analysis ( Read More )
SEPTEMBER 5, 2025 Conference Paper QECC-Synth: A Layout Synthesizer for Quantum Error Correction Codes on Sparse Architectures ( Read More )
SEPTEMBER 5, 2025 Journal Article Modeling Pb(II) Adsorption on Mineral Surfaces: Bridging Density Functional Theory and Experiment with Thermodynamic Insights ( Read More )
SEPTEMBER 5, 2025 Conference Paper HetEC: Architectures for Heterogeneous Quantum Error Correction Codes ( Read More )
SEPTEMBER 3, 2025 Journal Article Application-level Benchmarking of Quantum Computers using Nonlocal Game Strategies ( Read More )
SEPTEMBER 3, 2025 Journal Article The XPS of Pyridine: A Combined Theoretical and Experimental Analysis ( Read More )
AUGUST 29, 2025 Journal Article Imaging Domain Walls in van der Waals Ferroelectrics Using Tip-enhanced Second Harmonic Generation ( Read More )
AUGUST 14, 2025 Journal Article Trigonal Planar Bis(carbene)Cu(I) Complexes Enable Divergent H2 Activation with H2O for Accelerated Olefin Hydrogenation ( Read More )
AUGUST 13, 2025 Journal Article COLUMBUS - An Efficient and General Program Package for Ground and Excited State Computations Including Spin-Orbit Couplings and Dynamics ( Read More )
AUGUST 7, 2025 Journal Article Deep Quantum Circuit Simulations of Low-energy Nuclear States ( Read More )
AUGUST 1, 2025 Journal Article Quantum time dynamics mediated by the Yang-Baxter equation and artificial neural networks ( Read More )
JULY 24, 2025 Journal Article First principles study of molecular hydrogen activation by defects in boron nitride ( Read More )
JULY 12, 2025 Report A Review of Quantum Computing Technologies in Power System Optimization ( Read More )
JUNE 27, 2025 Journal Article Antiviral discovery using sparse datasets by integrating experiments, molecular simulations, and machine learning ( Read More )
JUNE 19, 2025 Journal Article Exploring the Nexus of Many-Body Theories through Neural Network Techniques: the Tangent Model ( Read More )
MAY 23, 2025 Journal Article Graph Characterization of Higher-Order Structure in Atmospheric Chemical Reaction Mechanisms ( Read More )
MAY 15, 2025 Conference Paper Adaptive Quantum Generative Training using an Unbounded Loss Function ( Read More )