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Quantum Self-Consistent Ab-Initio Lattice Dynamics

Ambroise van Roekeghem, Jesús Carrete, Natalio Mingo

2021Computer Physics Communications39 citationsDOIOpen Access PDF

Topics & Concepts

AnharmonicityAb initioLattice (music)QuantumCalculatorPython (programming language)PhysicsInteratomic potentialStatistical physicsQuantum mechanicsMolecular dynamicsComputer scienceAcousticsOperating systemElectronic and Structural Properties of OxidesFerroelectric and Piezoelectric MaterialsAdvanced Condensed Matter Physics
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