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ddr6021023ÖÁ×ðľ³æ (ÖøÃûдÊÖ)
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±¾ÈËÐÂÊÖ£¬ÔÚ±àÒëvaspºó£¬È»ºóÔËÐÐmpdrootºÍmpirun -np 4 vasp ,³öÏÖÒÔϽá¹û [root@localhost precell]# mpirun -np 4 vasp vasp.4.6.28 25Jul05 complex vasp.4.6.28 25Jul05 complex POSCAR found : 1 types and 1 ions POSCAR found : 1 types and 1 ions vasp.4.6.28 25Jul05 complex POSCAR found : 1 types and 1 ions vasp.4.6.28 25Jul05 complex POSCAR found : 1 types and 1 ions LDA part: xc-table for Ceperly-Alder, standard interpolation LDA part: xc-table for Ceperly-Alder, standard interpolation LDA part: xc-table for Ceperly-Alder, standard interpolation LDA part: xc-table for Ceperly-Alder, standard interpolation POSCAR, INCAR and KPOINTS ok, starting setup POSCAR, INCAR and KPOINTS ok, starting setup POSCAR, INCAR and KPOINTS ok, starting setup POSCAR, INCAR and KPOINTS ok, starting setup FFT: planning ... 1 reading WAVECAR FFT: planning ... 1 reading WAVECAR FFT: planning ... 1 reading WAVECAR FFT: planning ... 1 reading WAVECAR WARNING: random wavefunctions but no delay for mixing, default for NELMDL WARNING: random wavefunctions but no delay for mixing, default for NELMDL vasp: symbol lookup error: vasp: undefined symbol: zpotrf_ WARNING: random wavefunctions but no delay for mixing, default for NELMDL WARNING: random wavefunctions but no delay for mixing, default for NELMDL vasp: symbol lookup error: vasp: undefined symbol: zpotrf_ vasp: symbol lookup error: vasp: undefined symbol: zpotrf_ vasp: symbol lookup error: vasp: undefined symbol: zpotrf_ ÇëÎÊÊÇÔõôһ»ØÊÂÄØ£¿£¿ |
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- Ó¦Öú: 46 (СѧÉú)
- ¹ó±ö: 8.842
- ½ð±Ò: 7440.4
- É¢½ð: 9654
- ºì»¨: 118
- ɳ·¢: 23
- Ìû×Ó: 5306
- ÔÚÏß: 1961.4Сʱ
- ³æºÅ: 537452
- ×¢²á: 2008-04-01
- ÐÔ±ð: GG
- רҵ: ÀíÂۺͼÆË㻯ѧ
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mazuju028(½ð±Ò+1): лл½»Á÷ 2011-11-13 21:59:58
mazuju028(½ð±Ò+1): лл½»Á÷ 2011-11-13 21:59:58
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2Â¥2011-11-13 17:04:04
ddr6021023
ÖÁ×ðľ³æ (ÖøÃûдÊÖ)
- Ó¦Öú: 33 (СѧÉú)
- ½ð±Ò: 18822.1
- É¢½ð: 1880
- ºì»¨: 10
- Ìû×Ó: 2796
- ÔÚÏß: 1251.1Сʱ
- ³æºÅ: 1400276
- ×¢²á: 2011-09-13
- ÐÔ±ð: GG
- רҵ: µç»¯Ñ§
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¿ÉÊǼ´Ê¹ÊÇÔËÐС££¯vasp,Ò²»á³öÏÖÏÂÃæ vasp.4.6.28 25Jul05 complex POSCAR found : 1 types and 1 ions LDA part: xc-table for Ceperly-Alder, standard interpolation POSCAR, INCAR and KPOINTS ok, starting setup FFT: planning ... 1 reading WAVECAR WARNING: random wavefunctions but no delay for mixing, default for NELMDL vasp: symbol lookup error: vasp: undefined symbol: zpotrf_ ÕâÑùµÄ´íÎó£¬ÇëÎÊÊÇÎªÊ²Ã´ÄØ£¿£¿£¿ |
3Â¥2011-11-13 17:24:39
fzx2008
ÈÙÓþ°æÖ÷ (ÖøÃûдÊÖ)
- 1STÇ¿Ìû: 9
- Ó¦Öú: 272 (´óѧÉú)
- ¹ó±ö: 1.045
- ½ð±Ò: 21814.1
- É¢½ð: 710
- ºì»¨: 33
- ɳ·¢: 1
- Ìû×Ó: 1808
- ÔÚÏß: 1601Сʱ
- ³æºÅ: 621341
- ×¢²á: 2008-10-09
- ÐÔ±ð: GG
- רҵ: Äý¾Û̬ÎïÐÔ II £ºµç×ӽṹ
- ¹ÜϽ: µÚÒ»ÐÔÔÀí
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mazuju028(½ð±Ò+1): лл½»Á÷ 2011-11-13 22:00:06
mazuju028(½ð±Ò+1): лл½»Á÷ 2011-11-13 22:00:06
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4Â¥2011-11-13 17:31:14
ºØÒÇ
Ìú¸Ëľ³æ (ÖøÃûдÊÖ)
- 1STÇ¿Ìû: 5
- Ó¦Öú: 93 (³õÖÐÉú)
- ¹ó±ö: 0.636
- ½ð±Ò: 5937
- É¢½ð: 1063
- ºì»¨: 38
- ɳ·¢: 2
- Ìû×Ó: 2499
- ÔÚÏß: 588.7Сʱ
- ³æºÅ: 995125
- ×¢²á: 2010-04-12
- ÐÔ±ð: GG
- רҵ: Äý¾Û̬ÎïÐÔ II £ºµç×ӽṹ
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mazuju028(½ð±Ò+1): лл½»Á÷ 2011-11-13 22:00:34
ddr6021023(½ð±Ò+7): лл 2011-11-17 18:44:36
mazuju028(½ð±Ò+1): лл½»Á÷ 2011-11-13 22:00:34
ddr6021023(½ð±Ò+7): лл 2011-11-17 18:44:36
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ÏÈÔËÐÐ nohup mpd &£¬È»ºóÔÚÔËÐÐÄãµÄvasp £¬ mpirun -np 12 vasp, ÔÒòÊÇÔËÐÐmpirun±ØÐëÏÈÆô¶¯mpd£¬Ò»°ãµÄmpdÆô¶¯¼ÓÈëµ½Óû§Æô¶¯ÀïÁË£¬Èç¹ûûÓеϰÏÈÔËÐÐ nohup mpd & |

5Â¥2011-11-13 18:20:59
liliangfang
ÈÙÓþ°æÖ÷ (ÖøÃûдÊÖ)
- 1STÇ¿Ìû: 7
- Ó¦Öú: 138 (¸ßÖÐÉú)
- ¹ó±ö: 0.952
- ½ð±Ò: 10648.7
- É¢½ð: 4575
- ºì»¨: 42
- ɳ·¢: 3
- Ìû×Ó: 1856
- ÔÚÏß: 825.2Сʱ
- ³æºÅ: 1275010
- ×¢²á: 2011-04-23
- ÐÔ±ð: GG
- רҵ: ΢/ÄÉ»úеϵͳ
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mazuju028(½ð±Ò+1): лл½»Á÷ 2011-11-13 22:00:43
ddr6021023(½ð±Ò+7): лл 2011-11-17 18:44:49
mazuju028(½ð±Ò+1): лл½»Á÷ 2011-11-13 22:00:43
ddr6021023(½ð±Ò+7): лл 2011-11-17 18:44:49
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6Â¥2011-11-13 18:33:55
ddr6021023
ÖÁ×ðľ³æ (ÖøÃûдÊÖ)
- Ó¦Öú: 33 (СѧÉú)
- ½ð±Ò: 18822.1
- É¢½ð: 1880
- ºì»¨: 10
- Ìû×Ó: 2796
- ÔÚÏß: 1251.1Сʱ
- ³æºÅ: 1400276
- ×¢²á: 2011-09-13
- ÐÔ±ð: GG
- רҵ: µç»¯Ñ§
7Â¥2011-11-13 19:13:44
liliangfang
ÈÙÓþ°æÖ÷ (ÖøÃûдÊÖ)
- 1STÇ¿Ìû: 7
- Ó¦Öú: 138 (¸ßÖÐÉú)
- ¹ó±ö: 0.952
- ½ð±Ò: 10648.7
- É¢½ð: 4575
- ºì»¨: 42
- ɳ·¢: 3
- Ìû×Ó: 1856
- ÔÚÏß: 825.2Сʱ
- ³æºÅ: 1275010
- ×¢²á: 2011-04-23
- ÐÔ±ð: GG
- רҵ: ΢/ÄÉ»úеϵͳ
- ¹ÜϽ: µÚÒ»ÐÔÔÀí
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zzy870720z(½ð±Ò+1): ллÌáʾ 2011-11-14 15:23:44
zzy870720z(½ð±Ò+1): ллÌáʾ 2011-11-14 15:23:44
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ÎÒÕâÓиö32λϵͳϵ¥»ú±àÒëµÄ£¬Äã¿ÉÒԲο¼Ï http://muchong.com/bbs/viewthread.php?tid=3753433 |
8Â¥2011-11-13 19:23:24
ddr6021023
ÖÁ×ðľ³æ (ÖøÃûдÊÖ)
- Ó¦Öú: 33 (СѧÉú)
- ½ð±Ò: 18822.1
- É¢½ð: 1880
- ºì»¨: 10
- Ìû×Ó: 2796
- ÔÚÏß: 1251.1Сʱ
- ³æºÅ: 1400276
- ×¢²á: 2011-09-13
- ÐÔ±ð: GG
- רҵ: µç»¯Ñ§
9Â¥2011-11-13 20:01:18
liliangfang
ÈÙÓþ°æÖ÷ (ÖøÃûдÊÖ)
- 1STÇ¿Ìû: 7
- Ó¦Öú: 138 (¸ßÖÐÉú)
- ¹ó±ö: 0.952
- ½ð±Ò: 10648.7
- É¢½ð: 4575
- ºì»¨: 42
- ɳ·¢: 3
- Ìû×Ó: 1856
- ÔÚÏß: 825.2Сʱ
- ³æºÅ: 1275010
- ×¢²á: 2011-04-23
- ÐÔ±ð: GG
- רҵ: ΢/ÄÉ»úеϵͳ
- ¹ÜϽ: µÚÒ»ÐÔÔÀí
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franch(½ð±Ò+2): лл»ØÌû½»Á÷ 2011-11-14 20:27:53
franch(½ð±Ò+2): лл»ØÌû½»Á÷ 2011-11-14 20:27:53
| mpdboot ûÓоÍÊÇû°²×°³É¹¦ |
10Â¥2011-11-13 20:20:16














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