475 citations · 2.5k across the 26 of their papers we have counts for
26 papers
Finite temperature stability of quantized vortex structures in rotating Bose-Einstein condensates via complex Langevin simulation
Kimberlee Keithley, Kris T. Delaney, Glenn H. Fredrickson
The thermodynamic stability of quantized vortex patterns in rotating Bose-Einstein condensates is assessed at finite temperature using complex Langevin sampling. We construct a tem…
Emergence of a spin microemulsion in spin-orbit coupled Bose-Einstein condensates
Ethan C. McGarrigle, Kris T. Delaney, Leon Balents +1
We report the first numerical prediction of a "spin microemulsion" -- a phase with undulating spin domains resembling classical bicontinuous oil-water-surfactant emulsions -- in tw…
Machine Learning and Polymer Self-Consistent Field Theory in Two Spatial Dimensions
Yao Xuan, Kris T. Delaney, Hector D. Ceniceros +1
A computational framework that leverages data from self-consistent field theory simulations with deep learning to accelerate the exploration of parameter space for block copolymers…
Multiscale modeling of solute diffusion in triblock copolymer membranes
Anthony J. Cooper, Michael P. Howard, Sanket Kadulkar +5
We develop a multiscale simulation model for diffusion of solutes through porous triblock copolymer membranes. The approach combines two techniques: self-consistent field theory (S…
QMCPACK : An open source ab initio Quantum Monte Carlo package for the electronic structure of atoms, molecules, and solids
Jeongnim Kim, Andrew Baczewski, Todd D. Beaudet +45
QMCPACK is an open source quantum Monte Carlo package for ab-initio electronic structure calculations. It supports calculations of metallic and insulating solids, molecules, atoms,…
A finite element approach to self-consistent field theory calculations of multiblock polymers
David M. Ackerman, Kris Delaney, Glenn H. Fredrickson +1
Self-consistent field theory (SCFT) has proven to be a powerful tool for modeling equilibrium microstructures of soft materials, particularly for multiblock polymers. A very succes…