Magnetic moment calculations
Posted: Tue Jun 17, 2014 9:28 am
Hello,
I try to calculate the magnetic moment in Co nanowier on Au surface. After structural optimization I set ISPIN = 2 and MAGMOM = 20*0 2.8 (I have 20 Au atoms in substrate), and as a result I have 0 in magnetic moment. Then, I increased value in INCAR and set MAGMOM = 20*0 5.8. But I got 0 in OUTCAR again. I'm using PAW-GGA POTCAR. Can anyone help me to solve this problem? Thank you in advance!
I try to calculate the magnetic moment in Co nanowier on Au surface. After structural optimization I set ISPIN = 2 and MAGMOM = 20*0 2.8 (I have 20 Au atoms in substrate), and as a result I have 0 in magnetic moment. Then, I increased value in INCAR and set MAGMOM = 20*0 5.8. But I got 0 in OUTCAR again. I'm using PAW-GGA POTCAR. Can anyone help me to solve this problem? Thank you in advance!