699 citations · 938 across the 6 of their papers we have counts for
6 papers
NWChem: Past, Present, and Future
E. Aprà, E. J. Bylaska, W. A. de Jong +111
Specialized computational chemistry packages have permanently reshaped the landscape of chemical and materials science by providing tools to support and guide experimental efforts…
Quantum Simulations of Nuclei and Nuclear Pasta with the Multi-resolution Adaptive Numerical Environment for Scientific Simulations
I. Sagert, G. I. Fann, F. J. Fattoyev +2
Neutron star and supernova matter at densities just below the nuclear matter saturation density is expected to form a lattice of exotic shapes. These so-called nuclear pasta phases…
MADNESS: A Multiresolution, Adaptive Numerical Environment for Scientific Simulation
Robert J. Harrison, Gregory Beylkin, Florian A. Bischoff +22
MADNESS (multiresolution adaptive numerical environment for scientific simulation) is a high-level software environment for solving integral and differential equations in many dime…
Adaptive Multi-resolution 3D Hartree-Fock-Bogoliubov Solver for Nuclear Structure
Junchen Pei, George Fann, Robert Harrison +3
Complex many-body systems, such as triaxial and reflection-asymmetric nuclei, weakly-bound halo states, cluster configurations, nuclear fragments produced in heavy-ion fusion react…
Singular quadrature rules and fast convolutions for Fourier spectral methods
Jae-Seok Huh, George Fann
We present a generic scheme to construct corrected trapezoidal rules with spectral accuracy for integral operators with weakly singular kernels in arbitrary dimensions. We assume t…
Deformed Coordinate-Space Hartree-Fock-Bogoliubov Approach to Weakly Bound Nuclei and Large Deformations
J. C. Pei, M. V. Stoitsov, G. I. Fann +3
The coordinate space formulation of the Hartree-Fock-Bogoliubov (HFB) method enables self-consistent treatment of mean-field and pairing in weakly bound systems whose properties ar…