| 查看: 432 | 回复: 4 | |||
| 当前主题已经存档。 | |||
[交流]
【求助】vasp运行时出错了~
|
|||
|
各位高手请帮忙，很奇怪。我算76个原子。用了8个cpu。可是一提交任务就跳出来报错。是内存不足吗？我把INCAR和KPOINTS和err贴出来。请大家帮忙啊！！谢谢！ INCAR： SYSTEM ENCUT=400 ISTART=0 ICHARG=2 GGA = PE ISMEAR=0 SIGMA=0.1 KPOINTS： Automatic generation 0 Monkhorst-Pack 3 3 3 0.0 0.0 0.0 err： running on 8 nodes distr: one band on 1 nodes, 8 groups vasp.4.6.36 17Feb09 complex POSCAR found : 0 types and 0 ions p4_16694: p4_error: interrupt SIGSEGV: 11 p1_16526: p4_error: interrupt SIGx: 13 p2_16582: p4_error: interrupt SIGx: 13 p6_16806: p4_error: interrupt SIGx: 13 p5_16750: p4_error: interrupt SIGx: 13 Killed by signal 15.^M rm_l_4_16745: (0.964844) net_send: could not write to fd=5, errno = 32 Killed by signal 15.^M Killed by signal 15.^M Killed by signal 15.^M |
回复此楼» 猜你喜欢
版面费该交吗
已经有15人回复
-
面上可以超过30页吧？
已经有10人回复
-
体制内长辈说体制内绝大部分一辈子在底层，如同你们一样大部分普通教师忙且收入低
已经有18人回复
-
网上报道青年教师午睡中猝死、熬夜猝死的越来越多，主要哪些原因引起的？
已经有5人回复
-
为什么中国大学工科教授们水了那么多所谓的顶会顶刊，但还是做不出宇树机器人？
已经有10人回复
-
什么是人一生最重要的？
已经有4人回复
2楼2009-12-17 11:01:00
3楼2009-12-17 11:04:26
|
我的POSCAR是：麻烦帮我看一下，非常感谢！ SYSTEM 50 0 0 0 30 0 0 0 4.28 68 8 Cartesian 2.459500000 10.000000000 1.420000000 4.919000000 10.000000000 1.420000000 7.378500000 10.000000000 1.420000000 9.838000000 10.000000000 1.420000000 12.297600000 10.000000000 1.420000000 14.757100000 10.000000000 1.420000000 17.216600000 10.000000000 1.420000000 19.676100000 10.000000000 1.420000000 1.229800000 10.000000000 2.130000000 3.689300000 10.000000000 2.130000000 6.148800000 10.000000000 2.130000000 8.608300000 10.000000000 2.130000000 11.067800000 10.000000000 2.130000000 13.527300000 10.000000000 2.130000000 15.986800000 10.000000000 2.130000000 18.446300000 10.000000000 2.130000000 20.905900000 10.000000000 2.130000000 1.229800000 10.000000000 3.550000000 3.689300000 10.000000000 3.550000000 6.148800000 10.000000000 3.550000000 8.608300000 10.000000000 3.550000000 11.067800000 10.000000000 3.550000000 13.527300000 10.000000000 3.550000000 15.986800000 10.000000000 3.550000000 18.446300000 10.000000000 3.550000000 20.905900000 10.000000000 3.550000000 2.459500000 10.000000000 4.260000000 4.919000000 10.000000000 4.260000000 7.378500000 10.000000000 4.260000000 9.838000000 10.000000000 4.260000000 12.297600000 10.000000000 4.260000000 14.757100000 10.000000000 4.260000000 17.216600000 10.000000000 4.260000000 19.676100000 10.000000000 4.260000000 2.459500000 13.348000000 2.840000000 4.919000000 13.348000000 2.840000000 7.378500000 13.348000000 2.840000000 9.838000000 13.348000000 2.840000000 12.297600000 13.348000000 2.840000000 14.757100000 13.348000000 2.840000000 17.216600000 13.348000000 2.840000000 19.676100000 13.348000000 2.840000000 1.229800000 13.348000000 3.550000000 3.689300000 13.348000000 3.550000000 6.148800000 13.348000000 3.550000000 8.608300000 13.348000000 3.550000000 11.067800000 13.348000000 3.550000000 13.527300000 13.348000000 3.550000000 15.986800000 13.348000000 3.550000000 18.446300000 13.348000000 3.550000000 20.905900000 13.348000000 3.550000000 1.229800000 13.348000000 4.970000000 3.689300000 13.348000000 4.970000000 6.148800000 13.348000000 4.970000000 8.608300000 13.348000000 4.970000000 11.067800000 13.348000000 4.970000000 13.527300000 13.348000000 4.970000000 15.986800000 13.348000000 4.970000000 18.446300000 13.348000000 4.970000000 20.905900000 13.348000000 4.970000000 2.459500000 13.348000000 5.680000000 4.919000000 13.348000000 5.680000000 7.378500000 13.348000000 5.680000000 9.838000000 13.348000000 5.680000000 12.297600000 13.348000000 5.680000000 14.757100000 13.348000000 5.680000000 17.216600000 13.348000000 5.680000000 19.676100000 13.348000000 5.680000000 0.303153000 10.000000000 1.595000000 21.832547000 10.000000000 1.595000000 0.303153000 10.000000000 4.085000000 21.832547000 10.000000000 4.085000000 21.832547000 13.348000000 3.015000000 0.303153000 13.348000000 3.015000000 21.832547000 13.348000000 5.505000000 0.303153000 13.348000000 5.505000000 |
4楼2009-12-17 11:05:53
5楼2009-12-17 11:18:27