Training Datasets for Digital Twin of Diffusion Experiments

NIAID Data Ecosystem2026-05-02 收录

数字孪生模拟

扩散模拟

数据链接：

https://zenodo.org/record/11126484 数据链接链接失效反馈

官方服务：

资源简介：

This repository contains the training datasets generated from lattice Boltzmann simulations.

创建时间：

2024-05-07

How do rotational and translational diffusion influence each other for benzen...

表面物理吸附动力学

扩散模拟

The benzene/graphite diffusion is highly interesting as a model system for diffusion of physisorbed molecules in general and for the understanding of lubrication in carbon...

B2FIND70

Simulation trajectories from ab-initio molecular dynamics of 4x4x4 super cell of Li3OCl with 4 Li concentrations

固态电解质离子输运

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Lithium-rich oxychloride antiperovskites are promising solid electrolytes for enabling next-generation batteries. Here, we report a comprehensive study varying Li+ concentrations in Li3OCl using ab-in

NIAID Data Ecosystem60

Data and R Code for publication: Should dispersers be fast learners? Modelling the role of cognition in dispersal

行为生态学

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Both cognitive abilities and dispersal tendencies can vary strongly between individuals. Since cognitive abilities may help dealing with unknown circumstances it is conceivable that dispersers may rel

NIAID Data Ecosystem50

Molecular Simulations of CH4 and CO2 Diffusion in Rigid Nanoporous Amorphous Materials

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纳米多孔材料吸附

Molecular diffusion in nanoporous materials is important in determining the rate of equilibration of various adsorption processes and plays a pivotal role in kinetic separations and membrane-based sep

Figshare2022-05-06 更新60

Computer model buffers: concentrations, diffusion coefficients and binding kinetics.

扩散模拟

结合动力学建模

For details, see Methods.

NIAID Data Ecosystem50