CM
Cristiano Malica
cond-mat.mtrl-sciphysics.comp-phab initio phononsBatteriesCondensed-matter physicsDebye–Waller factorsdensity functional theoryElectronic properties and materialsthermal propertiesX-ray diffraction
On Valency
published · living versionsW_2usguvdd·v1 · currentpublished
Assessing the magnetic states and the accuracy of first-principles Hubbard corrections for the battery cathode LiCoO ()
with Valentina Sanella, Alberto Carta, Maria Andolfatto, Nicola Marzari +2
1 version
Preprints & journals
5 papers in the corpus · 2019–2026Assessing the magnetic states and the accuracy of first-principles Hubbard corrections for the battery cathode LiCoO ()2609.12984v1 · Valentina Sanella, Cristiano Malica, Alberto Carta et al.2026 · 0 citationsarXivon Valency
First-principles Hubbard parameters with automated and reproducible workflows.40535204 · Bastonero, Lorenzo, Malica, Cristiano, Macke, Eric et al.2026 · 9 citationsnpj computational materials. 2025;11(1):183
Teaching oxidation states to neural networks2412.01652v1 · Cristiano Malica, Nicola Marzari2024 · 4 citationsarXiv
Finite-temperature atomic relaxations: Effect on the temperature-dependent C44 elastic constants of Si and BAs.35597659 · Malica, Cristiano, Dal Corso, Andrea2022 · 4 citationsThe Journal of chemical physics. 2022;156(19):194111
Temperature-dependent atomic B factor: an ab initio calculation.31264646 · Malica, Cristiano, Dal Corso, Andrea2019 · 32 citationsActa crystallographica. Section A, Foundations and advances. 2019;75(Pt 4):624-632
Career total: 19 works. 5 are in this corpus.
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