2 papers
physics.comp-ph2018
Field-Programmable Gate Arrays and Quantum Monte Carlo: Power Efficient Co-processing for Scalable High-Performance Computing
Salvatore Cardamone, Jonathan R. Kimmitt, Hugh G. A. Burton +1
Massively parallel architectures offer the potential to significantly accelerate an application relative to their serial counterparts. However, not all applications exhibit an adeq…
physics.chem-ph2018
Modelling Electron Transfers Using Quasidiabatic Hartree-Fock States
Kristopher T. Jensen, Raz L. Benson, Salvatore Cardamone +1
Electron transfer processes are ubiquitous in chemistry and of great importance in many systems of biological and commercial interest. The ab-initio description of these processes…