First-principles calculation data for extrinsic defects in vanadium carbide
收藏NIAID Data Ecosystem2026-03-10 收录
官方服务：
资源简介：
Data to reproduce figures in manuscript.
应用场景：
创建时间：
2018-08-25
相关数据集
Materials Data on Ba2YV3O8 by Materials Project
Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For
DataCite Commons2021-02-04 更新60
NbV_BCC_SolidSolution_128atoms_VASP6 - DOI: 10.13139/OLCF/2228839
FILES contained in each subdirectory with name "case-N" where N ranges between 11 and 100, extremes included:1.INCAR: input file that contains various parameters and settings for controlling the behav
Figshare2024-05-13 更新30
First-principles calculations of equilibrium cerium isotope fractionation in aqueous solution and during adsorption onto goethite
Raw data for figures in the manuscript are listed in these Tables.
doi.org2023-12-13 更新30
Materials Data on Li13Mn2O9 by Materials Project
Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For
DataCite Commons2021-02-04 更新60
Datasets - Impact of complex adatom–induced interactions on quantum spin Hall phases
Data underlying article "Impact of complex adatom–induced interactions on quantum spin Hall phases" by F. J. Santos et al; to appear in Physical Review B, Rapid Communications; APS (2018). Content: AS
Figshare2018-08-06 更新30
