JUNE 7, 2023 Report The role of defects and solid/liquid interfacial interactions on controlling anisotropic growth of novel two-dimensional materials ( 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 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 )
SEPTEMBER 21, 2022 Journal Article Spiers Memorial Lecture: Assembly-based pathways of crystallization ( Read More )
APRIL 9, 2022 Journal Article Strong Purcell Enhancement at Telecom Wavelengths Afforded by Spinel Fe3O4 Nanocrystals with Size-Tunable Plasmonic Properties ( Read More )