3 papers
physics.chem-ph2026
A unified formalism for collinear and non-collinear approaches in the four-component Dirac-Kohn-Sham theory based on G-spinors
Giulia Gamboni, Loriano Storchi, Paola Belanzoni +1
Non-collinear density functional theories were developed to extend the use of established collinear exchange-correlation functionals to systems with unpaired electrons in the prese…
astro-ph.CO2025
gCAMB: A GPU-accelerated Boltzmann solver for next-generation cosmological surveys
L. Storchi, P. Campeti, M. Lattanzi +3
Inferring cosmological parameters from Cosmic Microwave Background (CMB) data requires repeated and computationally expensive calculations of theoretical angular power spectra usin…
physics.chem-ph2025
Automatic generation of density fitting auxiliary basis sets for all electron Dirac-Kohn-Sham calculations
Nicolo' Antonini, Enrico Ronca, Loriano Storchi +1
In this study, we present a general workflow that enables the automatic generation of auxiliary density basis sets for all elements of the periodic table (from H to Og) to facilita…