Pseudopotential File |
Test files |
Au.pbe-n-kjpaw_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: PAW Functional type: PBE Non Linear Core Correction Scalar relativistic | |
Au.pbe-n-rrkjus_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: USPP Functional type: PBE Non Linear Core Correction Scalar relativistic | |
Au.pbesol-n-kjpaw_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: PAW Functional type: PBESOL Non Linear Core Correction Scalar relativistic | |
Au.pbesol-n-rrkjus_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: USPP Functional type: PBESOL Non Linear Core Correction Scalar relativistic | |
Au.pbesol-spfn-kjpaw_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: PAW Functional type: PBESOL Non Linear Core Correction Scalar relativistic | |
Au.pbesol-spfn-rrkjus_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: USPP Functional type: PBESOL Non Linear Core Correction Scalar relativistic | |
Au.pbesol-spn-kjpaw_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: PAW Functional type: PBESOL Non Linear Core Correction Scalar relativistic | |
Au.pbesol-spn-rrkjus_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: USPP Functional type: PBESOL Non Linear Core Correction Scalar relativistic | |
Au.pbe-spfn-kjpaw_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: PAW Functional type: PBE Non Linear Core Correction Scalar relativistic | |
Au.pbe-spfn-rrkjus_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: USPP Functional type: PBE Non Linear Core Correction Scalar relativistic | |
Au.pbe-spn-kjpaw_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: PAW Functional type: PBE Non Linear Core Correction Scalar relativistic | |
Au.pbe-spn-rrkjus_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: USPP Functional type: PBE Non Linear Core Correction Scalar relativistic | |
Au.rel-pbe-n-kjpaw_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: PAW Functional type: PBE Non Linear Core Correction Full relativistic | |
Au.rel-pbe-n-rrkjus_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: USPP Functional type: PBE Non Linear Core Correction Full relativistic | |
Au.rel-pbesol-n-kjpaw_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: PAW Functional type: PBESOL Non Linear Core Correction Full relativistic | |
Au.rel-pbesol-n-rrkjus_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: USPP Functional type: PBESOL Non Linear Core Correction Full relativistic | |
Au.rel-pbesol-spfn-kjpaw_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: PAW Functional type: PBESOL Non Linear Core Correction Full relativistic | |
Au.rel-pbesol-spfn-rrkjus_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: USPP Functional type: PBESOL Non Linear Core Correction Full relativistic | |
Au.rel-pbesol-spn-kjpaw_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: PAW Functional type: PBESOL Non Linear Core Correction Full relativistic | |
Au.rel-pbesol-spn-rrkjus_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: USPP Functional type: PBESOL Non Linear Core Correction Full relativistic | |
Au.rel-pbe-spfn-kjpaw_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: PAW Functional type: PBE Non Linear Core Correction Full relativistic | |
Au.rel-pbe-spfn-rrkjus_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: USPP Functional type: PBE Non Linear Core Correction Full relativistic | |
Au.rel-pbe-spn-kjpaw_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: PAW Functional type: PBE Non Linear Core Correction Full relativistic | |
Au.rel-pbe-spn-rrkjus_psl.1.0.0.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.6.3 Pseudopotential type: USPP Functional type: PBE Non Linear Core Correction Full relativistic | |
Au.pbe-dn-kjpaw_psl.0.1.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9415 Pseudopotential type: PAW Functional type: PBE Non Linear Core Correction Scalar relativistic | |
Au.pbe-dn-rrkjus_psl.0.1.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9415 Pseudopotential type: USPP Functional type: PBE Non Linear Core Correction Scalar relativistic | |
Au.pbesol-dn-kjpaw_psl.0.1.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9415 Pseudopotential type: PAW Functional type: PBESOL Non Linear Core Correction Scalar relativistic | |
Au.pbesol-dn-rrkjus_psl.0.1.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9415 Pseudopotential type: USPP Functional type: PBESOL Non Linear Core Correction Scalar relativistic | |
Au.pz-dn-kjpaw_psl.0.1.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9415 Pseudopotential type: PAW Functional type: PERDEW-ZUNGER (LDA) exch-corr Non Linear Core Correction Scalar relativistic | |
Au.pz-dn-rrkjus_psl.0.1.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9415 Pseudopotential type: USPP Functional type: LDA Non Linear Core Correction Scalar relativistic | |
Au.rel-pbe-dn-kjpaw_psl.0.1.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9415 Pseudopotential type: PAW Functional type: PBE Non Linear Core Correction Full relativistic | |
Au.rel-pbe-dn-rrkjus_psl.0.1.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9415 Pseudopotential type: USPP Functional type: PBE Non Linear Core Correction Full relativistic | |
Au.rel-pbesol-dn-kjpaw_psl.0.1.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9415 Pseudopotential type: PAW Functional type: PBESOL Non Linear Core Correction Full relativistic | |
Au.rel-pbesol-dn-rrkjus_psl.0.1.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9415 Pseudopotential type: USPP Functional type: PBESOL Non Linear Core Correction Full relativistic | |
Au.rel-pz-dn-kjpaw_psl.0.1.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9415 Pseudopotential type: PAW Functional type: PERDEW-ZUNGER (LDA) exch-corr Non Linear Core Correction Full relativistic | |
Au.rel-pz-dn-rrkjus_psl.0.1.UPF
Origin: PS Library Author: ADC Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9415 Pseudopotential type: USPP Functional type: LDA Non Linear Core Correction Full relativistic |