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Quasi-Harmonic Approximation

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2 results in Keywords: Quasi-Harmonic Approximation

Theoretical and Computational Chemistry

Quasi-Harmonic Lattice Dynamics of a Prototypical Metal-Organic Framework

Matthew R. Ryder, Jefferson Maul, Bartolomeo Civalleri, Alessandro Erba

Version 1 posted 09 May 2019

565

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Materials Chemistry

Phase Stability of the Tin Monochalcogenides SnS and SnSe: A Quasi-Harmonic Lattice-Dynamics Study

Ioanna Pallikara, Jonathan Skelton

Version 3 posted 19 August 2021

1,115

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