1 citations · 1 across the 2 of their papers we have counts for
3 papers
cond-mat.mtrl-sci2021
Fast predictions of lattice energies by continuous isometry invariants of crystal structures
Jakob Ropers, Marco M Mosca, Olga Anosova +2
Crystal Structure Prediction (CSP) aims to discover solid crystalline materials by optimizing periodic arrangements of atoms, ions or molecules. CSP takes weeks of supercomputer ti…
cond-mat.mtrl-sci2020★ 1 cited
The asymptotic behaviour and a near linear time algorithm for isometry invariants of periodic sets
Daniel Widdowson, Marco Mosca, Angeles Pulido +2
The fundamental model of a periodic structure is a periodic point set up to rigid motion or isometry. Our recent paper in SoCG 2021 defined isometry invariants (density functions),…
cs.CG2020
Voronoi-based similarity distances between arbitrary crystal lattices
Marco Michele Mosca, Vitaliy Kurlin
This paper develops a new continuous approach to a similarity between periodic lattices of ideal crystals. Quantifying a similarity between crystal structures is needed to substant…