Direct derivation of anisotropic atomic displacement parameters from molecular dynamics simulations in extended solids with substitutional disorder using a neural network potential

Acta Crystallographica Section A
Acta Crystallographica
Section A FOUNDATIONS AND ADVANCES

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Figure 6
Schematic of atom distribution in a double-well potential.

FOUNDATIONS
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ISSN: 2053-2733

Volume 81| Part 4| July 2025| Pages 279-293

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