APRIL 30, 2024 Conference Paper FASDA: An FPGA-Aided, Scalable and Distributed Accelerator for Range-Limited Molecular Dynamics ( Read More )
APRIL 26, 2024 Journal Article Predicting spring phenology in deciduous broadleaf forests: NEON phenology forecasting community challenge ( Read More )
APRIL 23, 2024 Journal Article Range wide genetic differentiation in the bull kelp Nereocystis luetkeana with a seascape genetic focus on the Salish Sea ( Read More )
APRIL 20, 2024 Conference Paper Enabling Scalable VQE Simulation on Leading HPC Systems ( Read More )
APRIL 20, 2024 Journal Article Cavity Quantum Electrodynamics Complete Active Space Configuration Interaction Theory ( Read More )
APRIL 20, 2024 Journal Article G0W0 Ionization Potentials of First-Row Transition Metal Aqua Ions ( Read More )
APRIL 17, 2024 Journal Article Integrated quantum-classical protocol for the realistic description of solvated multinuclear mixed-valence transition-metal complexes and their solvatochromic properties ( Read More )
APRIL 13, 2024 Journal Article Development and Application of Hybrid AIMD/cDFT Simulations for Atomic-to-Mesoscale Chemistry ( Read More )
MARCH 30, 2024 Journal Article Transparency crucial to Paris climate scenarios—Response ( Read More )
MARCH 20, 2024 Journal Article Thermodynamic control on the decomposition of organic matter across different electron acceptors ( Read More )
MARCH 15, 2024 Journal Article Acceleration of Graph Neural Network-based Prediction Models in Chemistry via Co-design Optimization on Intelligence Processing Units ( Read More )
FEBRUARY 22, 2024 Journal Article Erratum Breaking covalent bonds in the context of the many-body expansion (MBE). I. The purported “first row anomaly” in XHn (X = C, Si, Ge, Sn; n = 1–4) [J. Chem. Phys. 156, 244303 (2022)] ( Read More )
FEBRUARY 20, 2024 Journal Article Accurate calculation of many-body energies in water clusters using a classical geometry-dependent induction model ( Read More )
FEBRUARY 16, 2024 Journal Article Topographic Correction of Optical Remote Sensing Images in Mountainous Areas: A Systematic Review ( Read More )
FEBRUARY 16, 2024 Journal Article Use-Inspired, Process-Oriented GCM Selection: Prioritizing Models for Regional Dynamical Downscaling ( Read More )
FEBRUARY 15, 2024 Journal Article Editorial: Advances in Observations and Modeling of Snow, Forest-Snow Processes and Snow Hydrology ( Read More )
FEBRUARY 15, 2024 Journal Article Cation Coordination Polyhedra Lead to Multiple Lengthscale Organization in Aqueous Electrolytes ( Read More )
FEBRUARY 15, 2024 Journal Article Triple excitations in Green's function coupled cluster solver for studies of strongly correlated systems in the framework of self-energy embedding theory ( Read More )
FEBRUARY 15, 2024 Book Chapter Harness the power of atomistic modeling and deep learning in biofuel separation ( Read More )
FEBRUARY 15, 2024 Journal Article A Perspective on Sustainable Computational Chemistry Software Development and Integration ( Read More )