Element = Mo

IDName

XC approx

XC Func Ultrasoft? psp class Nonlinear Corr. Relativ. SemicoreCode
138 Mo.pw91-n-van.UPF GGA PW91 Y Van Y N none QE
298 42mo.pspnc LDA TP N TM N N unknown Abinit
407 42-Mo.GGA.fhi GGA PBE N TM N N none Abinit
532 42mo.6.hgh LDA TP N HGH N N none Abinit
533 42mo.14.hgh LDA TP N HGH N N sp Abinit
680 Mo_HSCV_LDA-1.0.xml LDA PZ N HSCV N N none Qbox
681 Mo_HSCV_PBE-1.0.xml GGA PBE N HSCV N N none Qbox
901 Mo.psf LDA PZ N TM N N none Siesta
975 Mo-gga.psf GGA PBE N TM N N none Siesta
1048 Mo.rel-pbe-spn-kjpaw.UPF GGA PBE N PAW Y Y sp QE
1049 Mo.rel-pz-spn-kjpaw.UPF LDA PZ N PAW Y Y sp QE
1122 Mo.pbe-spn-kjpaw.UPF GGA PBE N PAW Y N sp QE
1123 Mo.pz-spn-kjpaw.UPF LDA PZ N PAW Y N sp QE

13 pseudopotentials found in the Virtual Vault

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