Chiara Ribaldone

8PUBLICATIONS
16CO-AUTHORS
Statistical mechanics, physical combinatorics and mathematical aspects of condensed matterQuantum computationNumerical solution of differential and integral equationsFormal methods for softwareTheoretical quantum chemistry
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Publications (8)

|May 05, 2026
Adiabatic Connection Methods Applied to Molecular Crystals.

|Jan 26, 2026
Nudged elastic band method in the CRYSTAL code: Theory and Applications.

Andreha Gelli, Silvia Casassa, Albert Rimola

|Aug 15, 2025
Spherical to Cartesian coordinates transformation for solid harmonics revisited: Construction of the Hartree potential.

Chiara Ribaldone, Jacques Kontak Desmarais

|Feb 25, 2025
Accelerated linear algebra for large scale DFT calculations of materials on CPU/GPU architectures with CRYSTAL.

Giacomo Ambrogio, Lorenzo Donà, Jacques K Desmarais

|Apr 22, 2024
Born-Oppenheimer Molecular Dynamics with a Linear Combination of Atomic Orbitals and Hybrid Functionals for Condensed Matter Simulations Made Possible. Theory and Performance for the Microcanonical and Canonical Ensembles.

Chiara Ribaldone, Silvia Casassa

|Mar 13, 2024
Crucial Role of Ni Point Defects and Sb Doping for Tailoring the Thermoelectric Properties of ZrNiSn Half-Heusler Alloy: An Ab Initio Study.

Eleonora Ascrizzi, Chiara Ribaldone, Silvia Casassa

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Frequent Collaborators

5 joint publications

Silvia Casassa

3 joint publications

Jacques Kontak Desmarais

3 joint publications

Bartolomeo Civalleri

3 joint publications

Lorenzo Donà