 |
 |
 |
 |
 |
 |
||
 |
 |
 |
 |
 |
| 5 | 1/1 | 返回列表 |
| 查看: 2696 | 回復(fù): 6 | |||
| 當(dāng)前只顯示滿足指定條件的回帖，點(diǎn)擊這里查看本話題的所有回帖 | |||
nehcevol鐵蟲 (初入文壇)
|
[求助]
求助VASP能帶計(jì)算的中斷原因
|
||
|
我用的兩個(gè)節(jié)點(diǎn)并行計(jì)算。發(fā)現(xiàn)算能帶結(jié)構(gòu)時(shí)，到最后一步總是出錯(cuò)，是否是因?yàn)樽詈髮懭氩ê瘮?shù)需要大內(nèi)存，導(dǎo)致退出呢？ 具體log如下所示： 而在OUTCAR的結(jié)尾，則可以看到如下信息 [ Last edited by nehcevol on 2013-1-26 at 13:21 ] |
回復(fù)此樓» 猜你喜歡
295求調(diào)劑
已經(jīng)有3人回復(fù)
-
一志愿211院校 344分 東北農(nóng)業(yè)大學(xué)生物學(xué)學(xué)碩，求調(diào)劑
已經(jīng)有8人回復(fù)
-
085602 307分 求調(diào)劑
已經(jīng)有5人回復(fù)
-
322求調(diào)劑
已經(jīng)有3人回復(fù)
-
高溫高壓反應(yīng)求助
已經(jīng)有3人回復(fù)
-
一志愿上海理工能源動(dòng)力（085800）310分求調(diào)劑
已經(jīng)有4人回復(fù)
-
食品工程專碩一志愿中海洋309求調(diào)劑
已經(jīng)有5人回復(fù)
-
285求調(diào)劑
已經(jīng)有5人回復(fù)
-
289求調(diào)劑
已經(jīng)有7人回復(fù)
-
求調(diào)劑
已經(jīng)有4人回復(fù)
» 本主題相關(guān)價(jià)值貼推薦，對(duì)您同樣有幫助:
- vasp畫能帶圖的疑問
已經(jīng)有12人回復(fù)
- 求助！沒有CHGCAR和WAVECAR生成！以前都有的，到底出了什么毛病~
已經(jīng)有17人回復(fù)
- 問題：vasp計(jì)算突然中斷，cpu利用率顯示為0，這是什么情況，沒有斷電
已經(jīng)有3人回復(fù)
- 求助關(guān)于用vasp計(jì)算二維石墨烯納米帶所得到的能帶結(jié)果與報(bào)道對(duì)不上
已經(jīng)有7人回復(fù)
- 求處理vasp能帶的小程序
已經(jīng)有14人回復(fù)
- 提取VASP的波函數(shù)，畫出按角動(dòng)量著色的絢麗能帶結(jié)構(gòu)
已經(jīng)有8人回復(fù)
- 能帶計(jì)算 vasp
已經(jīng)有11人回復(fù)
- 【求助】VASP計(jì)算體系性能沒有f能帶電子
已經(jīng)有24人回復(fù)
- 【求助】vasp計(jì)算Partial Charge，能帶交叉的如何確定IBAND？
已經(jīng)有13人回復(fù)
- 【求助】VASP計(jì)算能帶時(shí)KPOINTS設(shè)置出錯(cuò)
已經(jīng)有14人回復(fù)
- 【求助】vasp靜自洽計(jì)算中斷如何繼續(xù)
已經(jīng)有10人回復(fù)
- 【求助成功】VASP算出來的能帶和DOS圖對(duì)應(yīng)不上，哪里出了問題？
已經(jīng)有20人回復(fù)
- 【求助】Vasp計(jì)算能帶結(jié)構(gòu)，高對(duì)稱點(diǎn)如何在origin中表示
已經(jīng)有17人回復(fù)
- 【求助】求VASP計(jì)算ZnO能帶和態(tài)密度的詳細(xì)輸入設(shè)置
已經(jīng)有15人回復(fù)
- 【求助】請(qǐng)教vasp如何使本征值按每條能帶輸出
已經(jīng)有18人回復(fù)
|
我也遇到類似情況，發(fā)現(xiàn)服務(wù)器內(nèi)存沒有用到多少？是不是并行環(huán)境有問題？謝謝！ DA part: xc-table for Pade appr. of Perdew POSCAR, INCAR and KPOINTS ok, starting setup WARNING: small aliasing (wrap around) errors must be expected FFT: planning ...( 1 ) WAVECAR not read entering main loop N E dE d eps ncg rms rms(c) rank 14 in job 1 node1_56151 caused collective abort of all ranks exit status of rank 14: killed by signal 9 rank 12 in job 1 node1_56151 caused collective abort of all ranks exit status of rank 12: killed by signal 9 rank 35 in job 1 node1_56151 caused collective abort of all ranks exit status of rank 35: killed by signal 9 rank 29 in job 1 node1_56151 caused collective abort of all ranks exit status of rank 29: killed by signal 9 rank 28 in job 1 node1_56151 caused collective abort of all ranks exit status of rank 28: killed by signal 9 rank 27 in job 1 node1_56151 caused collective abort of all ranks exit status of rank 27: killed by signal 9 rank 26 in job 1 node1_56151 caused collective abort of all ranks exit status of rank 26: killed by signal 9 rank 25 in job 1 node1_56151 caused collective abort of all ranks exit status of rank 25: killed by signal 11 rank 24 in job 1 node1_56151 caused collective abort of all ranks exit status of rank 24: killed by signal 11 rank 47 in job 1 node1_56151 caused collective abort of all ranks exit status of rank 47: killed by signal 11 rank 46 in job 1 node1_56151 caused collective abort of all ranks exit status of rank 46: killed by signal 9 rank 45 in job 1 node1_56151 caused collective abort of all ranks exit status of rank 45: killed by signal 9 rank 38 in job 1 node1_56151 caused collective abort of all ranks exit status of rank 38: killed by signal 9 rank 37 in job 1 node1_56151 caused collective abort of all ranks exit status of rank 37: killed by signal 9 rank 36 in job 1 node1_56151 caused collective abort of all ranks exit status of rank 36: killed by signal 11 rank 11 in job 1 node1_56151 caused collective abort of all ranks exit status of rank 11: killed by signal 9 |
4樓2013-01-28 23:45:25
llh2010
至尊木蟲 (著名寫手)
- 應(yīng)助: 34 (小學(xué)生)
- 金幣: 10007.8
- 散金: 14
- 紅花: 11
- 帖子: 1614
- 在線: 350.1小時(shí)
- 蟲號(hào): 1471268
- 注冊(cè): 2011-11-01
- 性別: GG
- 專業(yè): 原子和分子物理
2樓2013-01-28 09:02:14
fzx2008
榮譽(yù)版主 (著名寫手)
- 1ST強(qiáng)帖: 9
- 應(yīng)助: 272 (大學(xué)生)
- 貴賓: 1.045
- 金幣: 21814.1
- 散金: 710
- 紅花: 33
- 沙發(fā): 1
- 帖子: 1808
- 在線: 1601小時(shí)
- 蟲號(hào): 621341
- 注冊(cè): 2008-10-09
- 性別: GG
- 專業(yè): 凝聚態(tài)物性 II ：電子結(jié)構(gòu)
- 管轄: 第一性原理
3樓2013-01-28 09:54:11
5樓2013-01-29 18:45:56
| 最具人氣熱帖推薦 [查看全部] | 作者 | 回/看 | 最后發(fā)表 | |
|---|---|---|---|---|
|
[考研] 295求調(diào)劑 +3 | 1428151015 2026-03-27 | 3/150 |
|
|---|---|---|---|---|
|
|
[考研] 289求調(diào)劑 +7 | 新時(shí)代材料 2026-03-27 | 7/350 |
|
|
[考研] 279 分 求調(diào)劑 +4 | 睡個(gè)好覺_16 2026-03-24 | 4/200 |
|
|
|
[考研] 化學(xué)308分求調(diào)劑 +8 | 你好明天你好 2026-03-23 | 9/450 |
|
|
|
[考研] 315調(diào)劑 +4 | 0860求調(diào)劑 2026-03-26 | 5/250 |
|
|
|
[考研] 276求調(diào)劑。有半年電池和半年高分子實(shí)習(xí)經(jīng)歷 +10 | 材料學(xué)257求調(diào)劑 2026-03-23 | 11/550 |
|
|
|
[考研] 材料調(diào)劑 +8 | 匹克i 2026-03-23 | 8/400 |
|
|
|
[考研] 求調(diào)劑，一志愿 南京航空航天大學(xué)大學(xué) ，080500材料科學(xué)與工程學(xué)碩 +4 | @taotao 2026-03-26 | 5/250 |
|
|
|
[考研]
材料調(diào)劑
 5+4
|
想要一壺桃花水 2026-03-25 | 10/500 |
|
|
|
[考研] 一志愿211 初試270分 求調(diào)劑 +6 | 谷雨上岸 2026-03-23 | 7/350 |
|
|
|
[考研] 一志愿河工大 081700 276求調(diào)劑 +4 | 地球繞著太陽轉(zhuǎn) 2026-03-23 | 4/200 |
|
|
|
[考研] 263求調(diào)劑 +6 | yqdszhdap－ 2026-03-22 | 10/500 |
|
|
|
[考研] 一志愿中南大學(xué)化學(xué)學(xué)碩0703總分337求調(diào)劑 +7 | niko- 2026-03-22 | 7/350 |
|
|
|
[考研] 考研一志愿蘇州大學(xué)初始315（英一）求調(diào)劑 +3 | sbdksD 2026-03-24 | 4/200 |
|
|
|
[考研] 296求調(diào)劑 +4 | 汪��？！ 2026-03-25 | 7/350 |
|
|
|
[考研] 各位老師您好：本人初試372分 +5 | jj涌77 2026-03-25 | 6/300 |
|
|
|
[考研] 292求調(diào)劑 +4 | 鵝鵝鵝額額額額?/a> 2026-03-24 | 4/200 |
|
|
|
[考研] 307求調(diào)劑 +3 | 余意卿 2026-03-21 | 6/300 |
|
|
|
[考博] 26申博自薦 +3 | whh869393 2026-03-24 | 3/150 |
|
|
|
[考研] 384求調(diào)劑 +3 | 子系博 2026-03-22 | 6/300 |
|