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SCF doesn't stop when EDIFF reached

Last post by support_vasp « Tue Sep 10, 2024 2:48 pm
Replies: 1
by wxiaom86 » Thu May 09, 2019 3:11 am

1 Replies

9997 Views

Last post by support_vasp
Tue Sep 10, 2024 2:48 pm
Can't run ALGO=EXACT or ACFDT with more than one MPI process

Last post by support_vasp « Tue Sep 10, 2024 2:48 pm
Replies: 1
by jcg_forum » Mon Mar 04, 2019 4:24 pm

1 Replies

12357 Views

Last post by support_vasp
Tue Sep 10, 2024 2:48 pm
J-dependent SOC in LDA+U

Last post by support_vasp « Tue Sep 10, 2024 2:48 pm
Replies: 1
by umklapp » Fri Sep 21, 2018 3:18 pm

1 Replies

9363 Views

Last post by support_vasp
Tue Sep 10, 2024 2:48 pm
EDWAV: internal error, the gradient is not orthogonal

Last post by support_vasp « Tue Sep 10, 2024 2:48 pm
Replies: 1
by augolotti » Wed Jul 11, 2018 10:58 pm

1 Replies

11512 Views

Last post by support_vasp
Tue Sep 10, 2024 2:48 pm
BSE ERROR The derivative of the wavefunctions with respect t

Last post by support_vasp « Tue Sep 10, 2024 2:48 pm
Replies: 1
by camille » Wed Jul 04, 2018 3:55 pm

1 Replies

9390 Views

Last post by support_vasp
Tue Sep 10, 2024 2:48 pm
NELM and algo=chi

Last post by support_vasp « Tue Sep 10, 2024 2:48 pm
Replies: 1
by oelerich » Thu Apr 12, 2018 12:19 pm

1 Replies

9252 Views

Last post by support_vasp
Tue Sep 10, 2024 2:48 pm
Convergence of ionic relaxation

Last post by support_vasp « Tue Sep 10, 2024 2:47 pm
Replies: 1
by MBaeker » Tue Oct 18, 2016 8:13 am

1 Replies

9085 Views

Last post by support_vasp
Tue Sep 10, 2024 2:47 pm
band energies precision

Last post by support_vasp « Tue Sep 10, 2024 2:46 pm
Replies: 1
by Rarras » Tue Mar 27, 2018 6:33 pm

1 Replies

8945 Views

Last post by support_vasp
Tue Sep 10, 2024 2:46 pm
Calculation of Dipole Transistion Elements

Last post by support_vasp « Tue Sep 10, 2024 2:46 pm
Replies: 1
by dscullion12 » Mon Sep 26, 2016 5:21 pm

1 Replies

8973 Views

Last post by support_vasp
Tue Sep 10, 2024 2:46 pm
ORBITALMAG facility: is this production-ready?

Last post by support_vasp « Tue Sep 10, 2024 2:46 pm
Replies: 1
by jzwanzig » Thu Sep 15, 2016 5:15 pm

1 Replies

7457 Views

Last post by support_vasp
Tue Sep 10, 2024 2:46 pm
BSE fatband include SOC error

Last post by support_vasp « Tue Sep 10, 2024 2:46 pm
Replies: 1
by leegeunsik » Thu Mar 08, 2018 3:34 pm

1 Replies

7452 Views

Last post by support_vasp
Tue Sep 10, 2024 2:46 pm
Error reading WAVECAR in non-collinear calculations

Last post by support_vasp « Tue Sep 10, 2024 2:46 pm
Replies: 1
by deepashri » Wed Feb 14, 2018 6:17 am

1 Replies

8540 Views

Last post by support_vasp
Tue Sep 10, 2024 2:46 pm
Im(eps) not zero for energies < band gap

Last post by support_vasp « Tue Sep 10, 2024 2:46 pm
Replies: 1
by rsaniz » Fri Dec 22, 2017 4:57 pm

1 Replies

3957 Views

Last post by support_vasp
Tue Sep 10, 2024 2:46 pm
ERROR FEXCF:supplied exchange-correlation table is too small

Last post by support_vasp « Tue Sep 10, 2024 2:46 pm
Replies: 1
by deepashri » Sat Nov 04, 2017 10:35 am

1 Replies

5070 Views

Last post by support_vasp
Tue Sep 10, 2024 2:46 pm
Optical properties with LOPTICS=True

Last post by support_vasp « Tue Sep 10, 2024 2:45 pm
Replies: 1
by IBRAHIM » Fri Nov 03, 2017 11:42 am

1 Replies

4212 Views

Last post by support_vasp
Tue Sep 10, 2024 2:45 pm
vdW-DF functionals with spin-orbit coupling

Last post by support_vasp « Tue Sep 10, 2024 2:45 pm
Replies: 1
by rrobles » Mon Oct 30, 2017 5:21 pm

1 Replies

4214 Views

Last post by support_vasp
Tue Sep 10, 2024 2:45 pm
Memory usage by VASP-5.4 HSE06 calculations

Last post by support_vasp « Tue Sep 10, 2024 2:45 pm
Replies: 1
by deepashri » Sat Apr 15, 2017 9:27 am

1 Replies

5299 Views

Last post by support_vasp
Tue Sep 10, 2024 2:45 pm
AECCAR0 file has NaNQ error

Last post by support_vasp « Tue Sep 10, 2024 2:45 pm
Replies: 1
by Marycalc » Fri Mar 10, 2017 2:10 pm

1 Replies

4555 Views

Last post by support_vasp
Tue Sep 10, 2024 2:45 pm
error in spin polarized wannier band plot

Last post by support_vasp « Tue Sep 10, 2024 2:45 pm
Replies: 1
by ntuxi » Wed Feb 22, 2017 4:42 am

1 Replies

4241 Views

Last post by support_vasp
Tue Sep 10, 2024 2:45 pm
Bug when computing dielectric constant for hexagonal lattice

Last post by support_vasp « Tue Sep 10, 2024 2:45 pm
Replies: 1
by jcconesa » Sun Nov 20, 2016 11:22 am

1 Replies

4689 Views

Last post by support_vasp
Tue Sep 10, 2024 2:45 pm

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