JUNE 30, 2023 Journal Article Ab initio Simulations of Tritium Diffusion in Al-rich Iron Aluminide Coating Phases ( Read More )
JUNE 23, 2023 Journal Article Disentangling the Confounding Spectroscopy of C1 Molecules: Without Symmetry as a Guide, Everything is Allowed ( Read More )
JUNE 23, 2023 Report First-Principles Study of Tritium Trapping by Point Defects in Fe-Al Aluminide Coating Phases ( Read More )
JUNE 23, 2023 Journal Article Revealing core-valence interactions in solution with femtosecond X-ray pump X-ray probe spectroscopy ( Read More )
JUNE 22, 2023 Journal Article Symmetry Breaking with the SCAN Density Functional Describes Strong Correlation in the Singlet Carbon Dimer ( Read More )
JUNE 11, 2023 Journal Article Isotope effects in the Zundel-Eigen Isomerization of H+(H2O)6 ( Read More )
MAY 5, 2023 Journal Article Electric Field Effects on Water and Ion Structure and Diffusion at the Orthoclase (001)–Water Interface ( Read More )
APRIL 29, 2023 Report Using Open Data to Characterize Building Stock Trends for Energy and Equity Evaluation ( Read More )
APRIL 11, 2023 Journal Article High-throughput ab initio reaction mechanism exploration in the cloud with automated multi-reference validation ( Read More )
MARCH 23, 2023 Journal Article Active Sampling for Neural Network Potentials: Accelerated Simulations of Shear-induced Deformation in Cu-Ni Multilayers ( Read More )
MARCH 7, 2023 Report PNNL CRADA No. 488, Amendment 2 with Natel Energy, Inc.: The Center Sender - CRADA 488 (Final Report) ( Read More )
FEBRUARY 18, 2023 Journal Article An initial investigation of accuracy required for the identifcation of small molecules in complex samples using quantum chemical calculated NMR chemical shifts ( Read More )
JANUARY 31, 2023 Conference Paper Detailed Laboratory Evaluation of Electric Demand Load Shifting Potential of Controlled Heat Pump Water Heaters ( Read More )
JANUARY 31, 2023 Report Policies to Decarbonize District Heating: International Best Practices ( Read More )
JANUARY 31, 2023 Conference Paper Field Study of Grid-connected Heat Pump Water Heaters in the Southeast U.S.: The Next Right Thing ( Read More )
JANUARY 31, 2023 Conference Paper Cold-Climate Packaged Heat Pumps - Resistance is Futile ( Read More )
JANUARY 31, 2023 Conference Paper Detailed Evaluation of Electric Demand Load Shifting Potential of Heat Pump Water Heaters ( Read More )
JANUARY 20, 2023 Journal Article Fock-space Schrieffer-Wolff transformation: classically-assisted rank-reduced quantum phase estimation algorithm. ( Read More )
JANUARY 13, 2023 Conference Paper International Actions to Reduce Miscellaneous Electrical Loads Energy Consumption ( Read More )