利用vaspkit233功能画3D能带图出现以下错误，（版本VASPKIT Standard Edition 1.5.1 (27 Jan. 2024）
================== 3D-Band-Structure ===========================
231) Generate KPOINTS File for 3D Band-Structure
232) 3D Band-Structure for 2D Material
233) 3D Band-Structure of HOMO & LUMO Bands [ISPIN=1 ONLY]
0) Quit
9) Back
------------>>
233
-->> (01) Reading Input Parameters From INCAR File.
+---------------------------------------------------------------+
| >>> The Fermi Energy will be set to zero eV <<< |
+---------------------------------------------------------------+
-->> (02) Reading Fermi-Energy from DOSCAR File.
-->> (03) Reading Energy-Levels From EIGENVAL File.
+-------------------------- Summary ----------------------------+
Interpolation Method: cubic
Interpolation Grid: 74 74
You CAN Reset the values of these parameters in ~/.vaspkit file.
+---------------------------------------------------------------+
-->> (04) Written BAND_HOMO.grd File.
-->> (05) Written BAND_LUMO.grd File.
-->> (06) Written KX.grd and KY.grd Files.
forrtl: severe (174): SIGSEGV, segmentation fault occurred
Image PC Routine Line Source
vaspkit 00000000009BD043 Unknown Unknown Unknown
libc.so.6 000014E88F649DF0 Unknown Unknown Unknown
vaspkit 0000000000A9A3E2 Unknown Unknown Unknown
vaspkit 0000000000A0DDFC Unknown Unknown Unknown
vaspkit 0000000000728267 plot_figure_ 190 plot.F90
vaspkit 00000000006222B1 band_3d_gen_ 225 get3dband.F90
vaspkit 00000000006FAEDF task_ 228 task.F90
vaspkit 00000000005E8B84 mainmenu_ 40 mainmenu.F90
vaspkit 00000000006BDC94 MAIN__ 29 main.F90
vaspkit 000000000040A762 Unknown Unknown Unknown
libc.so.6 000014E88F633CA8 Unknown Unknown Unknown
libc.so.6 000014E88F633D65 __libc_start_main Unknown Unknown
vaspkit 000000000040A669 Unknown Unknown Unknown
发表于 2025-10-28 16:29:06
