APRIL 23, 2025 Journal Article Capturing many-body correlation effects with quantum and classical computing ( Read More )
APRIL 11, 2025 Journal Article Exploring the exact limits of the real-time equation-of-motion coupled cluster cumulant Green's functions ( Read More )
APRIL 8, 2025 Journal Article Pairing a global optimization algorithm with EXAFS to characterize lanthanide structures in solution ( Read More )
MARCH 6, 2025 Journal Article Characterizing and communicating uncertainty: lessons from NASA’s Carbon Monitoring System ( Read More )
MARCH 6, 2025 Journal Article Electronic structure simulations in the cloud computing environment ( Read More )
FEBRUARY 14, 2025 Journal Article Provincial-Scale Assessment of Direct Air Capture to Meet China’s Climate Neutrality Goal Under Limited Bioenergy Supply ( Read More )
FEBRUARY 13, 2025 Journal Article The impact of regional resources and technology availability on carbon dioxide removal potential in the United States ( Read More )
FEBRUARY 13, 2025 Journal Article Applying equity principles leads to higher carbon removal obligations in Canada ( Read More )
JANUARY 30, 2025 Journal Article Comparing net zero pathways across the Atlantic A model inter-comparison exercise between the Energy Modeling Forum 37 and the European Climate and Energy Modeling Forum ( Read More )
JANUARY 15, 2025 Journal Article The accuracies of effective interactions in downfolding coupled-cluster approaches for small-dimensionality active spaces ( Read More )
JANUARY 15, 2025 Journal Article WFOT: a Wave Function Overlap Tool Between Single- and Multi-Reference Electronic Structure Methods for spectroscopy Simulation ( Read More )
JANUARY 8, 2025 Report Experimental measurement of the effective contact angle for solvent/packing interactions in a structured packed column for CO2 capture ( Read More )
JANUARY 8, 2025 Journal Article Machine Learning Prediction of Nitric Acid Extraction Behavior in PUREX Process ( Read More )
JANUARY 8, 2025 Conference Paper CHEMREASONER: Heuristic Search over a Large Language Model’s Knowledge Space using Quantum-Chemical Feedback ( Read More )
JANUARY 8, 2025 Journal Article Accelerating Computational Fluid Dynamics Simulation of Post-combustion Carbon Capture Modeling with MeshGraphNets ( Read More )
JANUARY 3, 2025 Journal Article Gigaton Commercial-Scale Carbon Storage and Mineralization Potential in Stacked Columbia River Basalt Reservoirs ( Read More )
DECEMBER 27, 2024 Journal Article NCAP: Noncanonical Amino Acid Parameterization Software for CHARMM Potentials ( Read More )
DECEMBER 26, 2024 Journal Article Structure-Composition Relationships for Mg-Ni and Mg-Fe Olivine ( Read More )
DECEMBER 20, 2024 Journal Article A new data-driven map predicts substantial undocumented peatland areas in Amazonia ( Read More )
DECEMBER 11, 2024 Journal Article Deployment expectations of multi-gigatonnes scale carbon removal could have adverse impacts on Asia’s energy-water-land nexus ( Read More )