| ²é¿´: 2452 | »Ø¸´: 11 | |||
| µ±Ç°Ö»ÏÔʾÂú×ãÖ¸¶¨Ìõ¼þµÄ»ØÌû£¬µã»÷ÕâÀï²é¿´±¾»°ÌâµÄËùÓлØÌû | |||
calos818ľ³æ (ÖøÃûдÊÖ)
ÐÂÈ˲ËÄñ
|
[½»Á÷]
¡¾ÇóÖú³É¹¦¡¿exit status of rank 5: killed by signal 9 ´íÎ󣿣¿£¿£¿ ÒÑÓÐ3È˲ÎÓë
|
||
|
VASP×ö´ÅÐÔ²ÄÁϵĽṹÓÅ»¯£¬30Ô×ÓµÄÔ°û£¬¼ÆËãÀÏÊÇÖÐÖ¹£¬ÏÔʾ´íÎóÐÅÏ¢ exit status of rank 5: killed by signal 9£¬²ÉÓÃIBRION=2 , ISMEAR =0;SIGMA=0.2, POTIM=0.1, DAV,ÇëÎÊ¿ÉÄÜÄÄÀï³öÎÊÌâÁË£¬Ð»Ð»´ó¼Ò [ Last edited by zzy870720z on 2011-4-25 at 17:11 ] |
» ²ÂÄãϲ»¶
0854×Ü·Ö272
ÒѾÓÐ4È˻ظ´
²ÄÁϹ¤³Ì274Çóµ÷¼Á
ÒѾÓÐ5È˻ظ´
272Çóµ÷¼Á
ÒѾÓÐ8È˻ظ´
¿ÎÌâ×é½ÓÊÕ²ÄÁÏÀàµ÷¼ÁÑо¿Éú
ÒѾÓÐ5È˻ظ´
261Çóµ÷¼Á
ÒѾÓÐ3È˻ظ´
»¯¹¤270Çóµ÷¼Á
ÒѾÓÐ9È˻ظ´
¿¼Ñи´ÊÔµ÷¼Á£¬¹ý¹ú¼ÒÏßµÄͬѧ¶¼¿É±¨Ãû
ÒѾÓÐ6È˻ظ´
0805×Ü·Ö292£¬Çóµ÷¼Á
ÒѾÓÐ9È˻ظ´
0856µ÷¼Á
ÒѾÓÐ8È˻ظ´
275Çóµ÷¼Á
ÒѾÓÐ7È˻ظ´
» ±¾Ö÷ÌâÏà¹ØÉ̼ÒÍÆ¼ö: (ÎÒÒ²ÒªÔÚÕâÀïÍÆ¹ã)
» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:
vasp¿ç½ÚµãÔËÐгö´í£¬mpiexec_node-1 (handle_stdin_input 1089)
ÒѾÓÐ5È˻ظ´
No initial positions read in
ÒѾÓÐ25È˻ظ´
¡¾ÇóÖú¡¿ÔËÐÐtransiestaʱºò³öÏÖµÄÒ»¸öÎÊÌâ
ÒѾÓÐ4È˻ظ´
¡¾ÇóÖú¡¿meshcutoff Õâ¸öÖµ
ÒѾÓÐ14È˻ظ´
¡¾ÇóÖú¡¿cutoff ¹ý´ó²úÉú´íÎó£¬ÔËËãÍ£Ö¹£¬´íÎóÈçÏÂ
ÒѾÓÐ6È˻ظ´
¡¾ÇóÖú¡¿vasp¾²Ì¬¼ÆËã³öÏÖµÄWARNING
ÒѾÓÐ18È˻ظ´
¡¾ÇóÖú¡¿vasp´íÎó£¬ÇóÖú
ÒѾÓÐ19È˻ظ´
¡¾ÇóÖú¡¿Transiesta ¼ÆËã³ö´í
ÒѾÓÐ8È˻ظ´
¡¾ÇóÖú¡¿vaspÓÅ»¯ÍŴسö´í ÇóPdµÄINCARÎļþ
ÒѾÓÐ21È˻ظ´
¡¾ÇóÖú¡¿VASP±àÒë³ö´í
ÒѾÓÐ5È˻ظ´
¡¾ÇóÖú¡¿Performing VASP: mpich2 someties breaks down
ÒѾÓÐ21È˻ظ´
¡¾ÇóÖú¡¿ÅÜvaspʱ, mpich2ÔËÐÐÓÐʱÓÐÎÊÌâ
ÒѾÓÐ6È˻ظ´
¡¾ÇóÖú¡¿vasp5.2Òì³£Í˳öµÄÎÊÌâ
ÒѾÓÐ16È˻ظ´
calos818
ľ³æ (ÖøÃûдÊÖ)
ÐÂÈ˲ËÄñ
- Ó¦Öú: 11 (СѧÉú)
- ½ð±Ò: 3125.7
- É¢½ð: 77
- ºì»¨: 3
- Ìû×Ó: 1201
- ÔÚÏß: 730.8Сʱ
- ³æºÅ: 698507
- ×¢²á: 2009-02-08
- רҵ: Äý¾Û̬ÎïÐÔ II £ºµç×ӽṹ
3Â¥2010-05-10 09:11:14
zzy870720z
ÈÙÓþ°æÖ÷ (ÎÄ̳¾«Ó¢)
- 1STÇ¿Ìû: 3
- Ó¦Öú: 47 (СѧÉú)
- ¹ó±ö: 9.05
- ½ð±Ò: 30914.3
- É¢½ð: 5613
- ºì»¨: 68
- ɳ·¢: 99
- Ìû×Ó: 12592
- ÔÚÏß: 23567.6Сʱ
- ³æºÅ: 745488
- ×¢²á: 2009-04-10
- ÐÔ±ð: GG
- רҵ: Äý¾Û̬ÎïÐÔI:½á¹¹¡¢Á¦Ñ§ºÍ
- ¹ÜϽ: ·Ö×ÓÄ£Äâ

2Â¥2010-05-10 08:56:44
zzy870720z
ÈÙÓþ°æÖ÷ (ÎÄ̳¾«Ó¢)
- 1STÇ¿Ìû: 3
- Ó¦Öú: 47 (СѧÉú)
- ¹ó±ö: 9.05
- ½ð±Ò: 30914.3
- É¢½ð: 5613
- ºì»¨: 68
- ɳ·¢: 99
- Ìû×Ó: 12592
- ÔÚÏß: 23567.6Сʱ
- ³æºÅ: 745488
- ×¢²á: 2009-04-10
- ÐÔ±ð: GG
- רҵ: Äý¾Û̬ÎïÐÔI:½á¹¹¡¢Á¦Ñ§ºÍ
- ¹ÜϽ: ·Ö×ÓÄ£Äâ

4Â¥2010-05-10 09:20:27
calos818
ľ³æ (ÖøÃûдÊÖ)
ÐÂÈ˲ËÄñ
- Ó¦Öú: 11 (СѧÉú)
- ½ð±Ò: 3125.7
- É¢½ð: 77
- ºì»¨: 3
- Ìû×Ó: 1201
- ÔÚÏß: 730.8Сʱ
- ³æºÅ: 698507
- ×¢²á: 2009-02-08
- רҵ: Äý¾Û̬ÎïÐÔ II £ºµç×ӽṹ
|
SYSTEM=relax PREC=Medium ISMEAR =0;SIGMA=0.2 ISPIN=2 ISIF=3 ISTART=0 ICHARG=2 EDIFF=1E-3 EDIFFG=-0.01 LREAL=Auto LCHARG=F LWAVE=F IBRION=2 POTIM=0.1 #LMAXMIX = 2 #AMIX = 0.2 #BMIX = 0.0001 #AMIX_MAG = 0.8 GGA=PE #ALGO=VeryFast ! equals to IALGO=48 PSTRESS=50 NELM=200 NSW=200 MAGMOM=0 0 0 0 0 0 5 -5 5 -5 5 -5 18*0 |
5Â¥2010-05-10 09:22:25













»Ø¸´´ËÂ¥