# Fileset

[vasp-settings.tar.xz](https://mdr.nims.go.jp/filesets/68417a0a-8059-47a5-9ff0-f81f7e3829cc/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 LiZnN / F-43m (216) / materials id 7575](https://mdr.nims.go.jp/datasets/2551586e-beb8-4506-bbf9-6c674a2592c2)

## Fulltext

vasp-settings/PAW_dataset.txtPAW_PBE Li_sv 10Sep2004PAW_PBE N 08Apr2002PAW_PBE Zn 06Sep2000vasp-settings/kpoints-mesh-relax4 4 4vasp-settings/INCAR-relaxEDIFF = 1e-08EDIFFG = -1e-08ENCUT = 648.7442GGA = PSIALGO = 38IBRION = 2ISIF = 3ISMEAR = 0LCHARG = .FALSE.LREAL = .FALSE.LWAVE = .FALSE.NELM = 100NELMIN = 5NPAR = 8NSW = 10PREC = AccurateSIGMA = 0.01SYSTEM = mp-7575vasp-settings/kpoints-mesh-nac7 7 7vasp-settings/kpoints-mesh-force2 2 2vasp-settings/INCAR-nacEDIFF = 1e-08ENCUT = 648.7442GGA = PSIALGO = 38IBRION = -1ISMEAR = 0LCHARG = .FALSE.LEPSILON = .TRUE.LREAL = .FALSE.LWAVE = .FALSE.NELM = 100NELMIN = 5PREC = AccurateSIGMA = 0.01vasp-settings/INCAR-forceADDGRID = .TRUE.EDIFF = 1e-08ENCUT = 648.7442GGA = PSIALGO = 38IBRION = -1ISMEAR = 0ISYM = 0LCHARG = .FALSE.LREAL = .FALSE.LWAVE = .FALSE.NELM = 200NELMIN = 5NPAR = 16PREC = AccurateSIGMA = 0.01