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JARVIS-DFT input/output files
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创建时间：
2020-06-21
相关数据集
Materials Data on SrMoO3 by Materials Project
SrMoO3 crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. Sr2+ is bonded in a 12-coordinate geometry to eight O2- atoms. There are four shorter (2.58 Å) and four lo
DataCite Commons2021-02-04 更新370
On periodic potentials on simple cubic lattice
Abstract This text is a simple adaptation of the characterization via Fourier series of a class of periodic potentials to the simple cubic lattice, originally developed in the honeycomb lattice, rigo
NIAID Data Ecosystem50
Code underlying the publication: A lattice model for transition zones in ballasted railway tracks
Source codes for the corresponding paper. The attached Matlab and Maple files are used for obtaining the results in the paper, but also demonstrate the derivations.
4TU.ResearchData2025-05-26 更新50
Materials Data on CeAlO3 by Materials Project
CeAlO3 is (Cubic) Perovskite structured and crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. Ce3+ is bonded to twelve O2- atoms to form CeO12 cuboctahedra that sh
DataCite Commons2024-11-04 更新90
Raw data used in the paper " Symmetrizing the Constraints – Density Matrix Renormalization Group for Constrained Lattice Models "
The zip file contains two folders:res: containing raw data for the triangular lattice with sites discarded to hold the VBS phase.res_smooth: containing raw data for the triangular lattice with smooth
DataCite Commons2025-04-17 更新50
