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 )
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 20, 2023 Journal Article Fock-space Schrieffer-Wolff transformation: classically-assisted rank-reduced quantum phase estimation algorithm. ( Read More )
JANUARY 20, 2023 Report Vouchers to Enable Laboratory and Organizational Collaboration for Innovation and Technology Improvements (VELOCITI) - CRADA 575 (Abstract) ( Read More )
JANUARY 13, 2023 Journal Article Evaluating Grid Strength Under Uncertain Renewable Generation ( Read More )
OCTOBER 27, 2022 Journal Article Stronger together: the value impacts of hybridizing distributed wind ( Read More )