Datasets for the paper "Large Scale Raman Spectrum Calculations in defective 2D materials using Deep Learning"

Name: Datasets for the paper "Large Scale Raman Spectrum Calculations in defective 2D materials using Deep Learning"
Creator: Université de Montréal
Published: 2024-01-01T00:00:00+08:00

The Canadian Dataverse Repository2024-01-01 更新2026-04-17 收录

缺陷二维材料拉曼光谱计算

深度学习模拟

数据链接：

https://borealisdata.ca/citation?persistentId=doi:10.5683/SP3/APCQ00 数据链接链接失效反馈

官方服务：

资源简介：

This contains the graphene and hexagonal boron nitride datasets used to train the models described in the paper "Large Scale Raman Spectrum Calculations in defective 2D materials using Deep Learning". They are in the ASE format as described here: https://wiki.fysik.dtu.dk/ase/tutorials/tut06_database/database.html

提供机构：

Université de Montréal

创建时间：

2024-01-01