Following are my input files:
INCAR:
SYSTEM = MONOLAYER-MoTe2
NCORE = 8
ENCUT = 500
ALGO = Fast
IBRION = 2
ISIF = 3
NSW = 1000
POTIM = 0.5
EDIFF = 1.0e-04
EDIFFG = -1.0e-02
ISYM = 2
LREAL = .FALSE.
ISMEAR = 0
SIGMA = 0.05
PREC = Accurate
ADDGRID = .TRUE.
NWRITE = 1
LCHARG = .FALSE.
LWAVE = .FALSE.
POSCAR:
Lattice="3.4624380306 0.0 0.0 0.0 6.3778258413 0.0 0.0 0.0 24.1947906566" pbc="T
1.0
5.2048149109 0.0000000000 0.0000000000
0.0000000000 5.2048149109 0.0000000000
0.0000000000 0.0000000000 5.2048149109
Te Mo
2 1
Cartesian
3.468016925 3.430004900 4.684332420
1.736797925 2.424706900 0.520481420
3.468016925 1.774809900 2.505570420
KPOINTS:
MoTe2 kpoints
0
Gamma
8 8 8
Following is one section of the output. Remaining part is similar to this, the simulation keeps on running:
<I'll add this later>
Why does it keep running?
OUTPUT: This is the short version of the output, it is still continuing
vasp.6.4.1 05Apr23 (build Oct 28 2023 16:19:38) complex
POSCAR found type information on POSCAR MoTe
POSCAR found : 2 types and 3 ions
scaLAPACK will be used selectively (only on CPU)
WARNING: type information on POSCAR and POTCAR are incompatible
POTCAR overwrites the type information in POSCAR
typ 1 type information: Mo Te
WARNING: type information on POSCAR and POTCAR are incompatible
POTCAR overwrites the type information in POSCAR
typ 2 type information: Te Mo
LDA part: xc-table for Pade appr. of Perdew
POSCAR found type information on POSCAR MoTe
POSCAR found : 2 types and 3 ions
POSCAR, INCAR and KPOINTS ok, starting setup
FFT: planning ... GRIDC
FFT: planning ... GRID_SOFT
FFT: planning ... GRID
WAVECAR not read
WARNING: random wavefunctions but no delay for mixing, default for NELMDL
entering main loop
N E dE d eps ncg rms rms(c)
DAV: 1 0.904471517361E+02 0.90447E+02 -0.55848E+03 1600 0.787E+02
DAV: 2 -0.104907564536E+02 -0.10094E+03 -0.91948E+02 2432 0.143E+02
DAV: 3 -0.199316962036E+02 -0.94409E+01 -0.90322E+01 2320 0.482E+01
DAV: 4 -0.202394212337E+02 -0.30773E+00 -0.30503E+00 2136 0.998E+00
DAV: 5 -0.202484089079E+02 -0.89877E-02 -0.89821E-02 2560 0.152E+00 0.118E+01
RMM: 6 -0.191293805966E+02 0.11190E+01 -0.29448E+00 1600 0.822E+00 0.427E+00
RMM: 7 -0.190394142383E+02 0.89966E-01 -0.66759E-01 1600 0.419E+00 0.184E+00
RMM: 8 -0.190273650247E+02 0.12049E-01 -0.14383E-01 1631 0.185E+00 0.374E-01
RMM: 9 -0.190294702033E+02 -0.21052E-02 -0.29395E-02 1668 0.758E-01 0.295E-01
RMM: 10 -0.190298746268E+02 -0.40442E-03 -0.45798E-03 1702 0.315E-01 0.227E-01
RMM: 11 -0.190300331916E+02 -0.15856E-03 -0.19075E-03 1591 0.195E-01 0.601E-02
RMM: 12 -0.190301007819E+02 -0.67590E-04 -0.61266E-04 1366 0.972E-02
1 F= -.19030101E+02 E0= -.19021067E+02 d E =-.190301E+02
curvature: 0.00 expect dE= 0.000E+00 dE for cont linesearch 0.000E+00
trial: gam= 0.00000 g(F)= 0.112E+00 g(S)= 0.155E+01 ort = 0.000E+00 (trialstep = 0.100E+01)
search vector abs. value= 0.166E+01
bond charge predicted
N E dE d eps ncg rms rms(c)
DAV: 1 -0.227837413203E+02 -0.37537E+01 -0.13438E+02 1744 0.724E+01 0.201E+01
RMM: 2 -0.188834972614E+02 0.39002E+01 -0.56995E+00 1600 0.130E+01 0.680E+00
RMM: 3 -0.184372419841E+02 0.44626E+00 -0.19530E+00 1611 0.714E+00 0.138E+00
RMM: 4 -0.183857418327E+02 0.51500E-01 -0.22392E-01 1605 0.290E+00 0.129E+00
RMM: 5 -0.183895974960E+02 -0.38557E-02 -0.83289E-02 1650 0.142E+00 0.106E+00
RMM: 6 -0.183883033496E+02 0.12941E-02 -0.17650E-02 1610 0.894E-01 0.282E-01
RMM: 7 -0.183876925054E+02 0.61084E-03 -0.12299E-02 1610 0.518E-01 0.156E-01
RMM: 8 -0.183879076639E+02 -0.21516E-03 -0.20329E-03 1664 0.234E-01 0.335E-01
RMM: 9 -0.183879444426E+02 -0.36779E-04 -0.28474E-04 1247 0.964E-02
2 F= -.18387944E+02 E0= -.18384504E+02 d E =0.642156E+00
trial-energy change: 0.642156 1 .order 1.008730 -1.661980 3.679440
step: 0.4108(harm= 0.3111) dis= 0.02134 next Energy= -19.396902 (dE=-0.367E+00)
bond charge predicted
N E dE d eps ncg rms rms(c)
DAV: 1 -0.210876285723E+02 -0.26997E+01 -0.44542E+01 1832 0.398E+01 0.108E+01
RMM: 2 -0.195357458270E+02 0.15519E+01 -0.25423E+00 1600 0.938E+00 0.436E+00
RMM: 3 -0.194343135143E+02 0.10143E+00 -0.71204E-01 1610 0.418E+00 0.203E+00
RMM: 4 -0.194173025656E+02 0.17011E-01 -0.10339E-01 1605 0.166E+00 0.574E-01
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