Consistent Modeling of Non-equilibrium Dust Sublimation and the Interactions with Dust Evolution in the Inner Regions of Protoplanetary Disks

Fuente: arXiv
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Main Authors: Xu, Sheng, Wang, Lile, Ho, Luis C., Cen, Renyue, Xu, Shenzhen
Format: Preprint
Published: 2025
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_version_ 1866909786517274624
author Xu, Sheng
Wang, Lile
Ho, Luis C.
Cen, Renyue
Xu, Shenzhen
author_facet Xu, Sheng
Wang, Lile
Ho, Luis C.
Cen, Renyue
Xu, Shenzhen
contents The inner regions of protoplanetary disks are host to the sublimation of dust grains, a process traditionally modeled using equilibrium thermodynamics. We demonstrate through ab-initio density functional theory (DFT) and kinetic Monte Carlo (KMC) simulations that silicate dust sublimation is inherently a non-equilibrium kinetic process. The binding energies and vibrational frequencies governing desorption, calculated for MgSiO3 and other compositions, reveal that sublimation timescales far exceed local dynamical times, allowing grains to persist in a superheated state. This kinetic inhibition results in a broad, dynamic sublimation front whose location and morphology are strongly regulated by radial advection and dust coagulation. Our coupled simulations, integrating sublimation with advection and grain evolution, show that the front varies radially by a factor of four with accretion rate and exhibits a vertically stratified, bowl-shaped structure. These findings imply that the inner disk dust distribution, thermal structure, and subsequent planet formation are profoundly influenced by the kinematics and kinetics of dust grains, necessitating a departure from equilibrium prescriptions in disk models and interpretations of inner rim observations.
format Preprint
id arxiv_https___arxiv_org_abs_2509_11036
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Consistent Modeling of Non-equilibrium Dust Sublimation and the Interactions with Dust Evolution in the Inner Regions of Protoplanetary Disks
Xu, Sheng
Wang, Lile
Ho, Luis C.
Cen, Renyue
Xu, Shenzhen
Earth and Planetary Astrophysics
The inner regions of protoplanetary disks are host to the sublimation of dust grains, a process traditionally modeled using equilibrium thermodynamics. We demonstrate through ab-initio density functional theory (DFT) and kinetic Monte Carlo (KMC) simulations that silicate dust sublimation is inherently a non-equilibrium kinetic process. The binding energies and vibrational frequencies governing desorption, calculated for MgSiO3 and other compositions, reveal that sublimation timescales far exceed local dynamical times, allowing grains to persist in a superheated state. This kinetic inhibition results in a broad, dynamic sublimation front whose location and morphology are strongly regulated by radial advection and dust coagulation. Our coupled simulations, integrating sublimation with advection and grain evolution, show that the front varies radially by a factor of four with accretion rate and exhibits a vertically stratified, bowl-shaped structure. These findings imply that the inner disk dust distribution, thermal structure, and subsequent planet formation are profoundly influenced by the kinematics and kinetics of dust grains, necessitating a departure from equilibrium prescriptions in disk models and interpretations of inner rim observations.
title Consistent Modeling of Non-equilibrium Dust Sublimation and the Interactions with Dust Evolution in the Inner Regions of Protoplanetary Disks
topic Earth and Planetary Astrophysics
url https://arxiv.org/abs/2509.11036