In a new approach, quantum flow algorithms are used to simulate many-body systems on quantum computers and effectively describe chemical processes.

A PNNL study developed a water management module for Xanthos that distinguishes between the operational characteristics of hydropower, irrigation, and flood control reservoirs.

Researchers designed a new, highly efficient, stable redox-active material from neutral red dye that can efficiently capture CO2 from air.

The ChemSpace Tool, when fully developed, is intended to divide chemical space into three subsets: the detectable space, the identifiable space, and the region that includes compounds that are not detectable or identifiable.

A combined experimental and theoretical study identified multiple interactions that affect the performance of redox-active metal oxides for potential electrochemical separation and quantum computing applications.

Microbes that were previously frozen in soils are becoming more active. This study demonstrates the diverse RNA viral communities found in thawed permafrost.

A new approach broadens the reach of quantum computers to previously challenging systems.

PNNL researchers developed a hybrid quantum-classical approach for coupled-cluster Green’s function theory that maintains accuracy while cutting computational costs.

The size of the alkali metal within the material influences the crystallization pathway.

Quantum simulators help navigate noise on GPU-based HPC systems.

Surface characterization allows researchers to explore the compatibility between different solvent-membrane combinations.

PNNL researchers utilized the Peeters-Devreese-Soldatov formulation to improve the accuracy of calculations for quantum chemistry.

A team of researchers developed a simulation approach to identify how atomic structures can affect the phonon transport of energy and information in quantum systems near absolute zero temperatures.

Using the connected moments mathematical technique decreases the time and computational power needed for performing quantum computing simulations.

Controlled synthesis and processing allow researchers to test how ions move through energy-relevant materials.