Heat transfer properties and molecular mechanisms of cuspidine (Ca4Si2O7F2): An atomic-scale molecular dynamics study

• Equilibrium molecular dynamics simulations were conducted to evaluate the thermal conductivity of cuspidine in the temperature range of 293 to 1673 K. • The thermal conductivity of cuspidine decreases significantly from 14.3 to 3.4 W/m·K with increasing temperature. • The phonon scattering is the...
Ausführliche Beschreibung

Gespeichert in:
Autor*in:

Huang, Shuheng [verfasserIn]

Wang, Zhe

Wang, Fanmao

Liu, Feng

Barati, Mansoor

Format:

E-Artikel

Sprache:

Englisch

Erschienen:

2022

Schlagwörter:

Cuspidine

Phonon

Molecular dynamics

Thermal conductivity

Vibration density of state

Übergeordnetes Werk:

Enthalten in: Plasticity in responses to dimensional variations of soil space in 19 grassland plant species - Dong, Ran ELSEVIER, 2022, Amsterdam [u.a.]

Übergeordnetes Werk:

volume:253 ; year:2022 ; day:18 ; month:05 ; pages:0

Links:

Volltext

DOI / URN:

10.1016/j.ces.2022.117594

Katalog-ID:

ELV057305218

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