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2026-01-23
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MS
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MSʹÓÃ
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qing_99
2015-06-05
2015-06-05 14:42:51
by
qing_99
[
Vasp&Me
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µÚÒ»ÐÔÔÀí·Ö×Ó¶¯Á¦Ñ§Ä£Äâ¾§Ìå²ÄÁÏÏà±ä
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future_wl
2015-05-15
2015-06-05 14:13:51
by
sungjen
[
Vasp&Me
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³õѧÕßÇë½Ì¼¸¸ö¹ØÓÚVASP¼ÆËã·Ö×Ó¶¯Á¦Ñ§µÄÎÊÌâ
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1
2
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¿à±ÆÅ£±Æ
2015-05-15
2015-06-05 14:09:07
by
sungjen
[
Vasp&Me
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Ã÷Ã÷´ïµ½ÁËÊÕÁ²±ê×¼£¬È´»¹ÔÚ¼ÆËã
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yysskk
2015-01-24
2015-06-05 13:38:57
by
490105179
[
Wien2k&
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ÇóÖúÓüÓSOC¼ÆËã¹âѧÐÔÖʵIJ½Ö裨ÓÃÃüÁîÐУ©
(2/827)
ÎÒ°®Ð¡Ô½Ô½
2015-06-04
2015-06-05 11:32:22
by
ÎÒ°®Ð¡Ô½Ô½
[
Vasp&Me
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£¨2X2X2µÄf.u.£©pnma¶Ô³ÆÐÔ40-atoms³¬°üPOSCARÔõô½¨£¿
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1
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djh434325996
2015-06-03
2015-06-05 09:18:01
by
xhzha
[
MS
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[ÒÑÍê½á]
castep¼¸ºÎÓÅ»¯ÎÊÌâ
(
1
2
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(11/2745)
tonglijia
2013-05-21
2015-06-05 08:43:45
by
ÓêÃεÄÐÇ¿Õ
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MS
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±¾ÈË×öÎÞ»ú²ÄÁϺϳɵģ¬Ïëѧµã¼ÆËãÈ»ºó½áºÏDFTÀíÂÛ×ö×ö²ÄÁÏÐÔÖÊ£¬¸÷λ֧֧ÕÐ
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²»Ã÷¾õÀ÷
2014-10-07
2015-06-05 06:58:52
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ssyexing
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ÆäËû
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ÇóÍÆ¼ö¹¤×÷Õ¾Æ·ÅÆ
(5/946)
silentocean
2015-06-02
2015-06-05 05:55:04
by
mailoliver
[
Vasp&Me
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¹ØÓÚÉù×ӯ׵ÄÎÊÌâ
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»ÃÁµÐ¡Óê
2015-06-03
2015-06-05 00:11:06
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»ÃÁµÐ¡Óê
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MS
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¹ØÓÚµ¯ÐÔ³£ÊýµÄÎÊÌ⣬ϣÍû³æÓѸøÓë°ïÖú£¬½ð±Ò»¹¿ÉÒÔÔټӵģ¡£¡£¡£¡£¡
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clown9111014
2015-06-04
2015-06-04 22:12:33
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clown9111014
[
QE(Pwsc
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windowsÏÂÔËÐÐQEÇóÖ¸µ¼
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1
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3
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(26/2952)
²»Ã÷¾õÀ÷
2015-05-29
2015-06-04 21:28:30
by
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[
Vasp&Me
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¡¾ÇóÖú¡¿vasp·Ö×Ó¶¯Á¦Ñ§ÎÊÌâ
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weiwei128
2011-03-21
2015-06-04 17:31:11
by
sungjen
[
Vasp&Me
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¡¾ÇóÖú¡¿vasp ·Ö×Ó¶¯Á¦Ñ§ÉèÖóõËÙ¶È
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zhangfan2192
2011-04-14
2015-06-04 17:23:49
by
sungjen
[
Vasp&Me
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VASPÄ£Äâ·Ö×Ó¶¯Á¦Ñ§µÄ¹ý³Ì
(5/2090)
hj1261363982
2014-05-08
2015-06-04 17:05:34
by
sungjen
[
Vasp&Me
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¹ØÓÚborn effective charge
(
1
2
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(58/5179)
spur
2012-05-08
2015-06-04 16:58:50
by
highpeter
[
Vasp&Me
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ÐÂÈË£¬ÎÊһϹØÓڽضϵãºÍkµã£¿
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sunСǿ
2015-06-04
2015-06-04 15:52:26
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sunСǿ
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Vasp&Me
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VASP+phonopyÉù×ӯ׵ÄÎÊÌâ
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1
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stevencong
2012-06-11
2015-06-04 15:45:12
by
ÐÄÖ®¹ý
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Vasp&Me
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VASP¼ÆËã³öÀ´µÄÄÜ´øÔõôÊÇÕâ¸öÑù×Ó£¿Çó½â´ð
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Ìì®ÐÇ
2015-06-03
2015-06-04 15:39:33
by
Ìì®ÐÇ
[
MS
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·ÑÃ×ÄÜÓë·Ö×Ó×ÜÄÜÁ¿µÄ¹ØÏµ
(7/871)
¹ÊÏçµÄһĨ·ç
2015-06-01
2015-06-04 14:59:46
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ÆäËû
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¹ÊÏçµÄһĨ·ç
2015-06-04
2015-06-04 14:37:32
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[
MS
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ËÓÐÁù·½ÏàLaPO4 ¾§¸ñ²ÎÊý
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zhangluo1207
2015-06-04
2015-06-04 11:02:38
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MS
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MsÄܼÆËã·´Ó¦½øÐг¹µ×µÄʱ¼äÂ𣿾ÍÊÇÈçºÎ׼ȷµÄÉè¼ÆÌÕ´ÉÉÕ½á»òÕßìÑÉյı£ÎÂʱ¼ä£¿
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ÇÅÉÏÈË
2015-04-01
2015-06-04 10:58:43
by
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[
MS
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ÕÅÒæÀ¤
2015-06-01
2015-06-04 09:17:49
by
ÕÅÒæÀ¤
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Vasp&Me
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ѧԱUKbkc5
2011-06-07
2015-06-04 06:30:46
by
xijinyang
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ÆäËû
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¿É¼«»¯ÐԵļÆËã
(2/1416)
qwerasdf2783
2015-06-03
2015-06-03 22:31:39
by
qwerasdf2783
[
ÈȵãÇ°ÑØ
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Çó½Ì£¬Ê²Ã´ÊÇnoncollinear spin-polarized calculations???
(0/453)
ǰÌïÇì´Î
2015-06-03
2015-06-03 19:44:38
by
ǰÌïÇì´Î
[
MS
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ÇóÖú£¬MS¾«ÐÞXRDµÄ¾§Á£´óСʱ×ÜÊÇ»á³ö´í
(0/341)
Ϊ×Ô¼º¸Ä±ä
2015-06-03
2015-06-03 19:02:44
by
Ϊ×Ô¼º¸Ä±ä
[
MS
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¡¾ÇóÖú¡¿MS5.0 for windowsÆô¶¯³öÏÖȱÉÙls_license_vs2008.dllÎļþÎÊÌâ
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1
2
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(15/4396)
chenweiguang
2010-03-29
2015-06-03 18:47:07
by
leibobobo
[
Vasp&Me
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[ÒÑÍê½á]
NEB¼ÆËãÎÊÌâÇóÖú
(7/2276)
julyrush5530
2015-05-26
2015-06-03 15:46:04
by
julyrush5530
[
Vasp&Me
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ÔõôÀûÓÃNEB¼ÆËãÀ©É¢ÊÆÀÝÖÐexchangeµÄÇé¿ö£¿
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¿ûcc_
2015-04-03
2015-06-03 13:15:48
by
¿ûcc_
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MS
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¸÷λ´óÏÀ¸Ï½ô°ïæ¿´¿´
(3/332)
haodalong218
2015-01-07
2015-06-03 12:35:05
by
lmsak
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ÆäËû
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gaussview¿´¹ìµÀ
(0/600)
baomamotuo
2015-06-03
2015-06-03 11:09:37
by
baomamotuo
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MS
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¡¾ÇóÖú¡¿ÈçºÎÓÃMSµÃµ½Õý·½ÐεÄʯīϩģÐÍ£¬Ä¬ÈÏÊÇÁâÐεÄ
(6/5246)
dndxwoaini
2011-02-23
2015-06-03 11:02:43
by
ÌÕ°®Å£
[
MS
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[ÒÑÍê½á]
°²×°MSÊÇÓöµ½ÎÊÌ⣬ ²âÊÔÀ¦°óJREʧ°Ü£¬Ó¦¸ÃÈçºÎ½â¾ö£¿
(1/1641)
xiongb123456
2015-03-10
2015-06-03 10:41:02
by
mpcctv
[
Vasp&Me
]
¡¾ÇóÖú¡¿Çë½ÌCNEB
(15/2552)
mzshchen
2011-03-24
2015-06-03 09:43:09
by
¿ûcc_
[
Vasp&Me
]
[ÒÑÍê½á]
VASP³ÚÔ¥¾¯¸æ WARNING: chargedensity file is incomplete
(
1
2
)
(11/3728)
xiewenze
2014-04-18
2015-06-03 07:33:46
by
ggginger24
[
Vasp&Me
]
[ÒÑÍê½á]
NEB¼ÆËã²»ÊÕÁ²
(3/1912)
LiСß÷
2015-06-02
2015-06-02 21:29:22
by
LiСß÷
[
Vasp&Me
]
[ÒÑÍê½á]
vasp¼ÆËãÖйØÓÚISIF=6µÄÉèÖÃÎÊÌâ
(3/1361)
happinesslyl
2015-06-01
2015-06-02 19:55:56
by
happinesslyl
[
MS
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ÔÚÓÃMSÔÚÇ¨ÒÆÄ£ÄâµÄÊÇ£¬¹ØÓÚ¾ù·½Î»ÒƵÄÎÊÌ⣿£¿£¿Çó´óÉñÖ¸µ¼
(0/501)
¹í¶·1990
2015-06-02
2015-06-02 17:15:14
by
¹í¶·1990
[
MS
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E(v)ÇúÏßÖ®ÃÕ
(3/513)
applegod
2015-06-01
2015-06-02 13:31:18
by
applegod
[
×ÊÔ´
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ÇóС³ÌÐòread_dos.f90£¬Ð»Ð»
(1/4947)
105668240
2014-12-30
2015-06-02 11:17:10
by
andychain
[
MS
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¾§¸ñ²ÎÊý±í½¨Ä£
(3/835)
ÎÒÊÇשͷ
2015-06-01
2015-06-02 09:07:51
by
future_wl
[
MS
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Castep¼ÆËãµÄfermiÄܼ¶Ó븯ʴÐÔÄܵÄÎïÀí¹ØÏµ
(3/557)
xiao9xie
2015-02-03
2015-06-02 06:51:49
by
·ÉÐÇ6
[
Vasp&Me
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ȱÏÝÀ©É¢¼ÆËã-³¬°û³ÚÔ¥ÎÊÌâ
(7/816)
andychain
2015-05-28
2015-06-02 00:57:14
by
dmbb
[
MS
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ÔÚÎÄÏ×Öп´µ½ÁËÒ»¸öMnO2µÄ½á¹¹£¬ÇëÎÊÊÇÔõô»³öÀ´µÄ
(4/1508)
ÁõСΰ110
2015-05-30
2015-06-01 21:11:45
by
ÁõСΰ110
[
Vasp&Me
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KµãÃܶȶÔÌåϵ´Å¾ØÓ°ÏìºÜ´ó£¿
(2/1380)
ÐÐÏÀÕÌÒå
2015-06-01
2015-06-01 19:44:33
by
¿¨¿ª·¢·¢
[
MS
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¹ØÓÚ ½á¹¹³ÚÔ¥ºóÔ×ÓµÄÎ»ÒÆÎÊÌâ
(2/1034)
СÎõС7
2015-06-01
2015-06-01 17:25:50
by
xxxxxxxfc
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ÆäËû
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Al3BCµÄÐγÉìÊÊǶàÉÙ£¿ÇóÖ¸µã
(1/598)
´óÍõ¼Þµ½
2015-05-29
2015-06-01 17:12:41
by
hy1987007
[
MS
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¡¾ÇóÖú¡¿¹ØÓÚ´øµçȱÏÝÔÓÖÊ×ÜÄܵÄÎÊÌâ
(4/1273)
chunying
2010-03-20
2015-06-01 16:09:43
by
xiewl
[
Vasp&Me
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[ÒÑÍê½á]
°ïÎÒ¿´¿´ NEBµÄINCAR POSCAR Ϊʲô×ܵô£¿
(
1
2
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(14/1933)
Ã÷ÔÂÀî
2011-11-18
2015-06-01 12:46:44
by
LiСß÷
[
Vasp&Me
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[ÒÑÍê½á]
VASPµÄAMIX£¬BMIXµÄÉèÖþÓÈ»¶Ô·ÑÃ×ÃæÒÔÉϵÄ̬ÃܶÈÓкܴóµÄÓ°Ï죡£¡£¡
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jugengfans
2012-06-09
2015-06-01 12:22:36
by
wmy8802217
[
Wien2k&
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ÇóÖú×ÔÐý¼«»¯Ï¹âѧÐÔÖÊÎÊÌâ
(0/621)
prince1000
2015-06-01
2015-06-01 12:07:43
by
prince1000
[
MS
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[ÒÑÍê½á]
ʲôÊÇÄÜÁ¿ÊÆÀÝ
(1/6020)
ÎÒÊÇשͷ
2015-06-01
2015-06-01 11:02:16
by
WanderingHeart
[
MS
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¡¾ÇóÖú¡¿ICSDµ¼³öcifÖÐûÓÐÇâÔ×Ó×ø±ê
(46/4992)
SouW2014
2013-12-03
2015-06-01 08:06:17
by
cheng¶þ½
[
MS
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castepµÈÄ£¿éµÄÓ¦ÓÃ
(3/946)
ÌìÁéÖ®»ê
2015-05-31
2015-06-01 07:59:50
by
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[
Vasp&Me
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VASP+phonopyËãÉù×ӯ׽á¹û»ìÂÒ
(6/2454)
FFFd3689
2013-06-26
2015-06-01 07:51:20
by
liuyunshenm
[
Vasp&Me
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NEBѰÕÒ¹ý¶É̬
(2/589)
1175704118
2015-03-22
2015-06-01 07:31:12
by
fxh0402
[
MS
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[ÒÑÍê½á]
¹ØÓÚÊÕÁ²ÎÊÌâ
(1/481)
gdwxky
2015-05-31
2015-05-31 21:02:35
by
gdwxky
[
MS
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castep̬ÃܶÈͼ¹ìµÀ·ÖÎö
(0/1974)
dianfu
2015-05-31
2015-05-31 18:15:40
by
dianfu
[
QE(Pwsc
]
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quantum espressoÇóÖú
(3/1482)
iamihanfei
2015-05-30
2015-05-31 11:10:07
by
KalaShayminS
[
Vasp&Me
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VASP¼ÆËãÄÜ´ø×ÜÊÇ×Ô¶¯Í£Ö¹
(
1
2
3
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(21/5048)
zhming1111
2014-08-26
2015-05-31 04:22:48
by
panzky
[
Vasp&Me
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СµÜÔÚѧϰÔõô×ö½çÃæ´¦Àí£¬ÓÃvaspËãµÄʱºòÔõô¹Ì¶¨Ô×Ó
(1/1370)
´÷´÷12345
2015-05-28
2015-05-30 16:23:45
by
magicmonk
[
MS
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ÌúËØÌåÌåÐÄÁ¢·½½¨Á¢MSÄ£ÐÍ
(2/1256)
luoluoasdf
2012-08-24
2015-05-30 14:21:51
by
ice311
[
Abinit
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ÔÚÌìºÓ¼¯ÈºÔõÑù°²×°abinit
(2/924)
Cautumn
2015-05-30
2015-05-30 14:15:04
by
WanderingHeart
[
Vasp&Me
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[ÒÑÍê½á]
ƵÂʼÆËãÑ¡ÔñÔ×ÓµÄÎÊÌâ
(6/823)
wangz00
2013-01-24
2015-05-30 11:10:30
by
wangz00
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Vasp&Me
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HSE06ÔÓ»¯·ºº¯¼ÆË㣬NPARÉèÖã¬ÎÞÂÛÔõôÉèÖö¼±¨´í
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1
2
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ºÚ°µÓÎÏÀ
2014-08-30
2015-05-30 09:05:02
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2015-05-30
2015-05-30 07:58:24
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yanglina062
2012-11-13
2015-05-29 19:32:24
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2015-05-29
2015-05-29 14:34:50
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2015-05-29
2015-05-29 14:13:33
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2015-05-29
2015-05-29 13:21:49
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2015-05-29
2015-05-29 11:19:19
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2015-05-29
2015-05-29 10:49:05
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2015-05-27
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2015-05-21
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2014-10-25
2015-05-28 20:46:02
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2015-05-28
2015-05-28 20:17:40
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2015-05-28
2015-05-28 17:58:26
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2011-12-05
2015-05-28 16:28:48
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2015-05-28
2015-05-28 14:55:18
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2015-05-11
2015-05-28 14:35:02
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2015-05-21
2015-05-28 14:29:32
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2013-05-24
2015-05-28 13:55:47
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2015-05-28
2015-05-28 09:08:49
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2015-05-27
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2015-05-27
2015-05-27 17:26:05
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2015-05-27
2015-05-27 17:07:12
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2015-05-26
2015-05-27 15:28:45
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2015-03-06
2015-05-27 15:26:54
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2015-01-09
2015-05-27 13:28:40
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2010-07-01
2015-05-27 11:58:02
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2011-02-16
2015-05-27 07:15:21
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2010-06-11
2015-05-27 06:57:50
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2015-05-18
2015-05-26 22:25:23
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2015-05-23
2015-05-26 21:34:42
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2015-05-26
2015-05-26 19:54:29
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2015-05-26
2015-05-26 19:43:33
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2015-05-26
2015-05-26 19:08:20
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2015-05-26
2015-05-26 18:07:25
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