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first_yg
2011-04-28
2011-04-28 16:59:24
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yq2240711
2011-04-28
2011-04-28 11:46:59
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stringer2018
2011-04-28
2011-04-28 09:31:38
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buct2010
2011-04-27
2011-04-28 08:33:43
by
buct2010
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lizeqian
2011-04-24
2011-04-27 22:57:23
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lizeqian
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donggaomin
2011-04-19
2011-04-27 18:57:42
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langren24
2011-04-07
2011-04-27 14:59:35
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taishasa
2011-01-19
2011-04-27 14:48:12
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ywyou
2011-02-19
2011-04-27 14:11:19
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yq2240711
2011-04-27
2011-04-27 11:51:33
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chem-yz
2011-04-18
2011-04-27 11:25:02
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2010-11-16
2011-04-26 14:34:19
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huangdan9604
2011-01-06
2011-04-26 14:14:02
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bnliu
2010-09-08
2011-04-26 11:51:18
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2011-04-20
2011-04-26 09:32:12
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2011-04-25
2011-04-25 23:53:51
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nkleof
2010-08-18
2011-04-25 22:25:52
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2011-04-25
2011-04-25 19:06:15
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2011-04-25
2011-04-25 18:52:16
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2011-04-25
2011-04-25 16:05:16
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2011-04-25
2011-04-25 15:01:53
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2011-02-27
2011-04-25 14:05:05
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2011-04-25
2011-04-25 13:58:24
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lizeqian
2011-04-23
2011-04-25 12:04:34
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2011-04-25
2011-04-25 11:18:27
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2011-04-21
2011-04-25 10:17:15
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2011-02-21
2011-04-24 12:33:20
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shxincui518
2011-04-23
2011-04-23 22:18:31
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fulin
2010-09-21
2011-04-23 21:27:27
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phys
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lizeqian
2011-04-23
2011-04-23 17:25:04
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zh060702012
2011-04-22
2011-04-22 20:59:58
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wangla
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Vasp&Me
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chuyong
2011-04-22
2011-04-22 13:30:18
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gaods101@163
2011-03-06
2011-04-22 09:43:23
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lizeqian
2011-04-21
2011-04-22 00:05:52
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yunest
2011-04-21
2011-04-21 17:39:57
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zhanganping
2011-04-21
2011-04-21 11:47:33
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positron
2011-04-19
2011-04-21 11:37:12
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saikun
2011-04-19
2011-04-21 09:53:06
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byin
2011-04-20
2011-04-20 21:24:32
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06022045
2011-04-20
2011-04-20 21:00:12
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2011-04-20
2011-04-20 18:33:12
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joannewanghf
2011-04-19
2011-04-20 10:56:41
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2011-04-19
2011-04-20 10:49:16
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Prettyswan
2010-12-14
2011-04-20 07:44:08
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2011-04-19
2011-04-19 20:29:47
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cenwanglai
2011-04-15
2011-04-19 17:46:37
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2010-05-17
2011-04-19 16:33:06
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ºØÒÇ
2011-04-19
2011-04-19 15:39:11
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byin
2011-04-13
2011-04-19 13:04:38
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wwt_wgs
2011-03-01
2011-04-19 12:09:43
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shalene
2011-04-18
2011-04-19 10:23:37
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¡¾ÇóÖú¡¿band calculation error
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ustbwgs
2011-04-17
2011-04-19 09:25:55
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liuhuimeiwoo
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ustbwgs
2011-04-17
2011-04-19 09:25:06
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cavediger
2011-04-19
2011-04-19 08:37:05
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bnliu
2010-09-13
2011-04-18 22:06:59
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cenwanglai
2011-04-14
2011-04-18 17:13:25
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dyc_2008
2011-04-17
2011-04-18 09:37:01
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yshl7237
2011-04-17
2011-04-17 21:36:25
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¡¾ÇóÖú¡¿DOSCAR
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ustbwgs
2011-04-03
2011-04-17 19:52:34
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wangla
2011-04-16
2011-04-17 19:11:45
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kuangfg1987
2011-04-15
2011-04-16 19:19:27
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VASP2010
2010-11-08
2011-04-16 07:09:35
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likai0106
2011-04-15
2011-04-15 16:02:01
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nkleof
2010-04-29
2011-04-15 14:28:28
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ustbwgs
2011-04-13
2011-04-15 11:30:59
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yongleli
2010-12-06
2011-04-15 11:25:44
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xiehui0608
2011-04-13
2011-04-15 10:56:26
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2009-11-13
2011-04-14 16:45:08
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cenwanglai
2010-09-10
2011-04-14 16:41:26
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wujiandongde
2011-04-11
2011-04-14 11:10:09
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dyc_2008
2011-04-14
2011-04-14 10:35:40
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zhang_jaj
2011-04-14
2011-04-14 09:53:41
by
zhang_jaj
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¡¾ÇóÖú¡¿VASP¼ÆËãWARNINGÇó½â
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youzhizhe
2011-04-12
2011-04-14 09:12:07
by
haowenping
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kmw.8668
2011-04-04
2011-04-14 08:51:42
by
kmw.8668
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Vasp&Me
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¡¾ÇóÖú¡¿partial pair radial distribution
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enola
2011-04-13
2011-04-14 08:48:53
by
enola
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ϦÑôÎ÷ÏÂ
2011-01-15
2011-04-13 23:01:50
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liuhuimeiwoo
2011-04-10
2011-04-13 18:59:35
by
bingmou
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hyff0809
2010-10-17
2011-04-13 17:15:23
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enola
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haowenping
2011-04-07
2011-04-13 14:44:15
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haowenping
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byin
2011-04-13
2011-04-13 14:42:09
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byin
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vasp001
2011-04-12
2011-04-13 09:48:24
by
cavediger
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¡¾ÇóÖú¡¿vasp±¨´í£¬WARNING in EDDRMM
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sxjsn1
2011-04-11
2011-04-13 08:38:37
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haowenping
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langren24
2011-03-25
2011-04-12 17:06:10
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cenwanglai
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fengchi2009
2011-04-12
2011-04-12 17:02:54
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fengchi2009
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06022043
2011-04-12
2011-04-12 15:04:49
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bingmou
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ºØÒÇ
2011-03-29
2011-04-12 10:28:56
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fulin
2011-04-11
2011-04-12 10:27:47
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fulin
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gleerat
2010-11-18
2011-04-12 08:37:20
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yangprc
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wujiandongde
2011-03-23
2011-04-11 21:19:38
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yangprc
2011-04-11
2011-04-11 18:42:04
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285058420
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ÍØº£1627
2011-04-09
2011-04-11 17:03:08
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liqian16
2011-04-09
2011-04-11 16:33:37
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liqian16
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dyc_2008
2011-04-11
2011-04-11 15:13:58
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cavediger
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¡¾ÇóÖú¡¿vasp+U¼ÆËã
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×ÓÐéÎÚÓÐ5388
2011-04-11
2011-04-11 14:29:58
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zhygeng511
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¡¾ÇóÖú¡¿ÇóÖúÈÈÁ¦Ñ§±í
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hbl626
2011-02-17
2011-04-11 13:47:52
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w_wwb
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¡¾ÇóÖú¡¿vasp·´Ìú´ÅºÍÌú´Å¼ÆËã
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weiwei128
2011-04-10
2011-04-11 09:51:11
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wangla
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¡¾ÇóÖú¡¿ÎÞ·¨ÊÕÁ²
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ustbwgs
2011-03-25
2011-04-10 16:16:01
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haowenping
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¡¾ÇóÖú¡¿¼ÆËãSi£¬ZnOÕâÀà°ëµ¼Ìåʱ£¬ISMEAR=-5¡£ÎªºÎÎÞÂÛSIGMAȡʲôֵ£¬entropy¾ùΪÁã
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tider
2011-04-09
2011-04-09 22:34:02
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tider
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yq2240711
2011-04-09
2011-04-09 21:18:16
by
bingmou
[
Vasp&Me
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byin
2011-04-09
2011-04-09 21:15:10
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