:: Library Catalog

Cover Image

Saved in:

Bibliographic Details
Main Authors:	Shi, Guoyong, Deng, Fenglin, He, Ri, Chen, Dachuan, Chen, Xuejiao, Jiang, Peiheng, Zhong, Zhicheng
Format:	Preprint
Published:	2025
Subjects:	Materials Science
Online Access:	https://arxiv.org/abs/2503.06039
Tags:	Add Tag No Tags, Be the first to tag this record!

Similar Items

Charge and spin instabilities in superconducting La$_3$Ni$_2$O$_7$
by: Chen, Xuejiao, et al.
Published: (2023)

Spontaneous curvature in two-dimensional van der Waals heterostructures
by: Gao, Yuxiang, et al.
Published: (2024)

Atomistic simulations of thermodynamic properties of liquid gallium from first principles
by: Wu, Hongyu, et al.
Published: (2023)

Domain and switching dynamics in antiferroelectric PbZrO3: Machine learning molecular dynamics simulation
by: Yubai Shi, et al.
Published: (2025)

Interplay of metallicity, ferroelectricity and layer charges in SmNiO$_3$/BaTiO$_3$ superlattices
by: Simmen, Edith, et al.
Published: (2024)

Atomistic simulations of thermodynamic properties with nuclear quantum effects of liquid gallium from first principles
by: Hongyu Wu, et al.
Published: (2025)

Neural network impurity solver for real-frequency dynamical mean-field theory
by: Deng, Fenglin, et al.
Published: (2025)

A compositional ordering-driven morphotropic phase boundary in ferroelectric solid solutions
by: Shi, Yubai, et al.
Published: (2024)

Sliding Flexoelectricity in Two-Dimensional van der Waals Systems
by: He, Ri, et al.
Published: (2024)

Dual instability of superconductivity from oxygen defects in La$_3$Ni$_2$O$_{7+δ}$
by: Jiang, Peiheng, et al.
Published: (2025)

An overview about neural networks potentials in molecular dynamics simulation
by: Raidel Martin‐Barrios, et al.
Published: (2024)

KFO-Atlas - A molecular atlas of key food odorants
by: Zhang, Jingzhi, et al.
Published: (2026)

Transferable potential for molecular dynamics simulations of borosilicate glasses and structural comparison of machine learning optimized parameters
by: Yang, Kai, et al.
Published: (2025)

A phase transition for the two-dimensional random field Ising/FK-Ising model
by: Hao, Chenxu, et al.
Published: (2025)

A phase transition and critical phenomenon for the two-dimensional random field Ising model
by: Ding, Jian, et al.
Published: (2023)

T-MSD: An improved method for ionic diffusion coefficient calculation from molecular dynamics
by: Gao, Yuxiang, et al.
Published: (2025)

Large-scale Atomistic Simulation of Quantum Effects in SrTiO$_3$ from First Principles
by: Wu, Hongyu, et al.
Published: (2022)

Temperature dependent structure of low index copper surfaces studied by molecular dynamics simulation
by: F. J. Resende
Published: (2004)

Combining stochastic density functional theory with deep potential molecular dynamics to study warm dense matter
by: Chen, Tao, et al.
Published: (2023)

Structural transitions of calcium carbonate by molecular dynamics simulation
by: Sidler, Elizaveta, et al.
Published: (2024)

Collision of surfactant-laden droplets: insights from molecular dynamics simulation
by: Arbabi, Soheil, et al.
Published: (2025)

How cancer emerges: Data-driven universal insights into tumorigenesis via hallmark networks
by: Wang, Jiahe, et al.
Published: (2025)

Data-driven modeling of unsteady flow based on deep operator network
by: Bai, Heming, et al.
Published: (2024)

Time-dependent random phase approximation for particle-number fluctuations and correlations in deep-inelastic collisions of $^{144}$Sm+$^{144}$Sm and $^{154}$Sm+$^{154}$Sm
by: Gao, Zepeng, et al.
Published: (2025)

Undamped Soliton-like Domain Wall Motion in Sliding Ferroelectrics
by: Shi, Yubai, et al.
Published: (2025)

Band gap tuning by structural phase transition in Sm-substituted BiFeO3 powders
by: Hill, Christina, et al.
Published: (2025)

A two‐step sizing method for multistage Op Amps based on behavioral initial sizing followed by Spice‐in‐the‐loop refining
by: Qixu Xie, et al.
Published: (2024)

Non-excitonic mechanism for electronic and structural phase transitions in Ta2Ni(Se,S)5
by: Tang, Weichen, et al.
Published: (2025)

Dimension-raising phase transitions in driven magnets and condensates
by: Chen, Zhizhen, et al.
Published: (2025)

The effect of ligands on the size distribution of copper nanoclusters: insights from molecular dynamics simulations
by: Elishav, Oren, et al.
Published: (2024)

Process simulation on oxy‐fuel combustion of coal and biomass in a circulating fluidized bed
by: Xuejiao Liu, et al.
Published: (2025)

Understanding phase transitions of $α$-quartz under dynamic compression conditions by machine-learning driven atomistic simulations
by: Erhard, Linus C., et al.
Published: (2024)

Quantitative evaluation of nuclear quantum effects on the phase transitions in BaTiO3 using large-scale molecular dynamics simulations based on machine learning potentials
by: Kanayama, Kansei, et al.
Published: (2024)

Charge-localization-driven metal-insulator phase transition in layered molecular conductors
by: Priya, Savita, et al.
Published: (2025)

Quantum simulation of dynamical phase transitions in noisy quantum devices
by: Javanmard, Younes, et al.
Published: (2022)

Experimental observation of spontaneous symmetry breaking in a quantum phase transition
by: Ning, Wen, et al.
Published: (2024)

Mechanisms of the structure evolution in irradiated silica glass: A view from molecular dynamics simulations
by: Jiawei Liu, et al.
Published: (2025)

Relation between equilibrium quantum phase transitions and dynamical quantum phase transitions in two-band systems
by: Zeng, Yumeng, et al.
Published: (2024)

Quantum channel tomography: optimal bounds and a Heisenberg-to-classical phase transition
by: Chen, Kean, et al.
Published: (2026)

Accelerating molecular vibrational spectra simulations with a physically informed deep learning model
by: Chen, Yuzhuo, et al.
Published: (2024)