# Fileset

[vasp-settings.tar.xz](https://mdr.nims.go.jp/filesets/b4ee98c1-c970-4b6c-97b4-be5375d8df1b/download)

## Creator

[Atsushi Togo](https://orcid.org/0000-0001-8393-9766)

## Rights

Creative Commons Attribution 4.0 International[Creative Commons BY Attribution 4.0 International](https://creativecommons.org/licenses/by/4.0/)

## Other metadata

[First-principles lattice thermal conductivity calculation for DyGaO3 / Pnma (62) / materials id 755612](https://mdr.nims.go.jp/datasets/b161c54d-3f08-4601-be61-05c6908d2b66)

## Fulltext

vasp-settings/PAW_dataset.txtPAW_PBE Dy_3 06Sep2000PAW_PBE Ga_d 06Jul2010PAW_PBE O 08Apr2002vasp-settings/kpoints-mesh-relax4 3 4vasp-settings/INCAR-relaxEDIFF = 1e-08ENCUT = 520.0GGA = PSIALGO = 38ISMEAR = 0LCHARG = .FALSE.LREAL = .FALSE.LWAVE = .FALSE.NELM = 100NELMIN = 5NPAR = 4PREC = AccurateSIGMA = 0.01SYSTEM = mp-755612vasp-settings/kpoints-mesh-nac4 3 4vasp-settings/kpoints-mesh-force2 3 2vasp-settings/INCAR-nacEDIFF = 1e-08ENCUT = 520.0GGA = PSIALGO = 38IBRION = -1ISMEAR = 0LCHARG = .FALSE.LEPSILON = .TRUE.LREAL = .FALSE.LWAVE = .FALSE.NELM = 100NELMIN = 5PREC = AccurateSIGMA = 0.01vasp-settings/INCAR-forceADDGRID = .TRUE.EDIFF = 1e-08ENCUT = 520.0GGA = PSIALGO = 38IBRION = -1ISMEAR = 0ISYM = 0LCHARG = .FALSE.LREAL = .FALSE.LWAVE = .FALSE.NELM = 200NELMIN = 5NPAR = 16PREC = AccurateSIGMA = 0.01