24小时热门版块排行榜    

管理团队 (金币库 94326.6 充值 )

主管区长:
月只蓝小红豆
主管版主:
漫天飘雪蛋蛋小童鞋franch
11%最高出勤率

杰出贡献者

回帖排序 发表排序 刷新页面  |  交流  |  求助  |  资源精华区 作者 最后发表
[热点] 关于filecode 布布和一二 2026-08-11 刚刚
[MS] 【讨论】讨论一下,用ms计算系统能量问题 (4/1869) gongchangjie 2010-06-02 2010-09-22 09:09:17 by wanglianli136
[MS] 【求助】CASTEP 算出的弹性常数怎么没有C44 (1/537) btvipvip 2010-09-21 2010-09-22 07:41:59 by babaleo
[MS] 【求助】求助:由态密度图如此推导的导电机制,如何理解?    ( 1 2 ) (19/5080) 森然晶 2010-09-15 2010-09-21 16:04:23 by 森然晶
[MS] 【求助】计算单个Sn原子的分波态密度 (2/592) liangping3881 2010-06-02 2010-09-21 15:57:44 by guolianshun
[MS] 【求助】改变超胞中某种原子的颜色 (4/780) 森然晶 2010-09-21 2010-09-21 15:41:38 by 森然晶
[MS] 【求助】请教:Al掺杂的ZnO中如何计算H在各个位置上的生产能 (7/1152) kuangwei1984 2010-09-20 2010-09-21 15:20:52 by kuangwei1984
[MS] 【求助】the vibrational frequency of the ith normal mode.? (1/369) xbb421987 2010-09-21 2010-09-21 10:53:27 by fanchen021
[MS] 【求助】MS 安装问题 (1/310) zhanglx8632 2010-09-21 2010-09-21 10:07:52 by 夕阳西下
[MS] 【求助】Al3Zr、Al3Sc态密度分析 (8/1899) icyspace 2010-05-23 2010-09-21 08:55:35 by guolianshun
[MS] 【求助】如何建立Si(100)面的重构表面 (2/664) fly_zhanglei 2010-05-28 2010-09-21 08:51:36 by guolianshun
[MS] 【求助】MS中Si(111)-7x7面怎么建? (7/847) feiyumeng 2010-09-20 2010-09-21 08:33:38 by feiyumeng
[MS] 【求助】电子密度等势线最小值和间隔值如何设置? (2/402) freshman8185 2010-09-20 2010-09-21 05:58:13 by yindeqiang
[MS] 【求助】请教,为何MS算得的带隙和实验值存在很大差距? (7/2653) scream 2010-05-25 2010-09-20 20:52:33 by luobenhua
[MS] 【求助】discover运行问题 (2/391) nancy-jj 2010-09-19 2010-09-20 20:33:07 by nancy-jj
[MS] 【转帖】Materials Studio5.0中的新技术 (28/8015) zzy870720z 2009-11-03 2010-09-20 18:25:42 by cuphunter
[MS] 【求助】关于castep ecut 测试!    ( 1 2 ) (19/1823) gongjijun 2010-07-21 2010-09-20 16:48:10 by guolianshun
[MS] 【求助】castepexe._mpi (2/329) baoyan 2010-09-20 2010-09-20 16:42:14 by baoyan
[MS] 【求助】大家装 MS前,系统的补丁在哪下的啊 (2/340) blueybz 2010-09-16 2010-09-20 16:03:17 by blueybz
[MS] 【求助】MS打不开 (7/1412) snowmami 2010-09-17 2010-09-20 15:56:08 by 眉峰
[MS] 【求助】优化提示错误(castep) (5/868) dzhijie 2010-09-16 2010-09-20 15:53:32 by zxzj05
[MS] [关贴]【求助】请大家看看 (8/739) guolianshun 2010-09-18 2010-09-20 15:23:30 by guolianshun
[MS] 【求助】castep计算能带 (9/2382) 雨泪3168 2009-10-09 2010-09-20 12:07:21 by 夕阳西下
[MS] 【求助】ms4.0装到win7 上不能运算,那位大侠给解决一下!谢谢! (5/847) liang7035 2010-09-19 2010-09-20 10:30:09 by xiaoke_w
[MS] 【求助】MS的管理! (6/1042) zmj110 2010-09-19 2010-09-20 09:03:34 by zmj110
[MS] 【求助】体模量偏大的问题 (8/1520) limin2007 2010-09-17 2010-09-20 08:19:32 by limin2007
[MS] 【求助】这个问题怎么解决 (1/989) 老鹰01 2010-09-19 2010-09-19 21:42:18 by fzx2008
[MS] 【求助】优化结构时的晶体形状文件怎么恢复 (2/353) mouse3511 2010-09-18 2010-09-19 17:09:11 by fangyuan5687
[MS] 【求助】能带结构分析    ( 1 2 ) (13/1264) 313838515 2010-06-15 2010-09-19 14:15:28 by zxzj05
[MS] 【求助】自旋污染 (6/990) sdjgdu 2010-09-13 2010-09-19 12:48:27 by sdjgdu
[MS] 【求助】收敛 (4/854) newton3915 2010-05-28 2010-09-19 12:41:18 by cenwanglai
[MS] 【求助】收敛设置问题 (4/1026) shelay 2010-06-17 2010-09-19 10:00:56 by guolianshun
[MS] 【求助】吸附成功了,但是没有castep文件是怎么回事啊? (4/831) liang7035 2010-06-20 2010-09-19 09:41:11 by guolianshun
[MS] 【放弃求助】COMPASS力场能用于金属有机物的计算吗? (2/1300) qiangwxr 2010-06-17 2010-09-19 08:30:01 by qiangwxr
[MS] 【求助】Castep计算时如何设置压力收敛呢? (0/392) tranquilseaside 2010-09-18 2010-09-18 16:46:44 by tranquilseaside
[MS] 【求助】态密度 (6/742) shuai87101 2010-05-26 2010-09-18 11:47:39 by guolianshun
[MS] 【求助】MS5.0应用程序异常? (0/247) dyk325 2010-09-17 2010-09-18 09:38:04 by dyk325
[MS] 【求助】请教高手,掺Al氧化锌中周围不同位置的H的生成能用何公式计算啊? (0/256) kuangwei1984 2010-09-17 2010-09-18 09:37:59 by kuangwei1984
[MS] [关贴]【求助】MS计算介电常数时polarization如何设置? (1/1209) casjxm 2010-09-17 2010-09-17 17:20:58 by guolianshun
[MS] 【求助】点击FORCITE进行几何结构优化出现OnConnect error! (2/395) lifenliu 2010-09-16 2010-09-17 13:10:57 by Tower.Tsu
[MS] 【求助】做吸附需不需要溶剂化呢? (0/303) 端木青 2010-09-17 2010-09-17 10:32:20 by 端木青
[MS] 【求助】MS计算DOS请教 (6/1074) lxrui 2010-09-16 2010-09-17 10:05:31 by scq123
[MS] 【求助】安装ms的 install license时老是出错 (2/997) wjhxjdx 2010-09-16 2010-09-17 09:59:52 by wjhxjdx
[MS] 【求助】ms创建一个新的project的时候出错 (7/842) bubuweiying 2010-09-16 2010-09-17 09:39:33 by xiaoke_w
[MS] 【求助】文件怎样上传服务器啊 (1/524) guolianshun 2010-09-16 2010-09-17 08:50:28 by ym23
[MS] 【求助】MS 安装问题(期待高手解决) (4/645) sss3012 2010-09-16 2010-09-17 08:04:55 by sss3012
[MS] 【求助】结构优化 (0/361) newton3915 2010-09-16 2010-09-16 20:08:44 by newton3915
[MS] 【求助】压力下几何结构的变化问题。    ( 1 2 ) (10/1307) 鲤鱼飞 2010-09-14 2010-09-16 18:08:14 by 鲤鱼飞
[MS] 【求助】用MS计算固溶体的可行性 (6/1298) crystalgirl1 2010-09-02 2010-09-16 17:57:49 by aylayl08
[MS] 【求助】请帮忙分析CASTEP为什么不能算 (6/845) g_xq96 2010-09-15 2010-09-16 17:12:06 by ljl8209
[MS] 【求助】计算表面 (3/969) liuhongge1 2010-09-16 2010-09-16 16:01:36 by guolianshun
[MS] 【求助】什么是RASHBA 效应 (0/1538) 思想家 2010-09-16 2010-09-16 13:09:48 by 思想家
[MS] 【求助】fedora 13可以安装MS4.4吗? (4/539) blueybz 2010-09-15 2010-09-16 09:37:39 by zhengjinde
[MS] 【求助】请教,fedora下能否安装material studio?    ( 1 2 ) (12/2616) 04nylxb 2010-09-14 2010-09-16 04:28:07 by babaleo
[MS] 【求助】Dmol计算能带时的k点设置问题 (3/1042) yuhong2891 2010-09-14 2010-09-15 23:31:44 by vasp001
[MS] 【求助】请问为何这个金属是否没法做phonos计算? (0/256) 鲤鱼飞 2010-09-15 2010-09-15 22:58:53 by 鲤鱼飞
[MS] 【求助】安装Materials Studio 总是提示JRE 环境找不到, (0/923) vasp001 2010-09-15 2010-09-15 21:37:26 by vasp001
[MS] 【求助】MS打不开怎么回事呢 (3/1014) xiaodiandian 2010-09-15 2010-09-15 19:17:06 by wjhxjdx
[MS] 【求助】如何利用castep计算的能带结果绘制布里渊区? (4/2267) xtrlcj 2010-09-12 2010-09-15 18:50:06 by spatial
[MS] 【求助】石墨烯吸附的位置研究 (0/429) baoyan 2010-09-15 2010-09-15 17:22:14 by baoyan
[MS] 【求助】吸附计算时原子半径的误差问题 (2/332) baoyan 2010-09-15 2010-09-15 16:56:04 by baoyan
[MS] 【求助】内坐标及结合能 (1/307) guyudan 2010-09-15 2010-09-15 16:17:01 by baoyan
[MS] 【求助】布居数 (3/2774) liuhongge1 2010-05-27 2010-09-15 15:39:09 by luobenhua
[MS] 【求助】各位路过的大虫,做过discover的大虫!请留步 (4/723) 端木青 2010-09-14 2010-09-15 12:43:11 by 端木青
[MS] 【求助】结构优化后,静态计算竟然失败? (8/2564) ddang100 2010-08-26 2010-09-15 09:30:35 by gongjijun
[MS] 【求助】帮忙拟合一下 (7/1383) laidaohui 2010-09-02 2010-09-14 23:01:46 by 思想家
[MS] 【求助】布局数分析 (4/1457) lishufei 2010-09-13 2010-09-14 21:57:26 by mouse3511
[MS] 【求助】MS中MPI的问题 (4/791) clszxh02 2010-09-13 2010-09-14 19:01:05 by clszxh02
[MS] 【求助】计算成功,数据没下载下来怎么办?请高手指导。 (5/466) zhanglx8632 2010-09-14 2010-09-14 18:59:37 by zhanglx8632
[MS] 【求助】MD问题:Anderson方法和Nose方法 (1/482) siga5609 2010-09-14 2010-09-14 17:17:54 by enola
[MS] 【求助】ms安装不上怎么弄?    ( 1 2 ) (15/1988) 张丽英 2010-09-13 2010-09-14 16:01:36 by aaq2800
[MS] 【求助】高压下 单壁碳纳米管的相变后的结构 (1/502) zhangjunkai 2010-09-14 2010-09-14 14:52:21 by valenhou001
[MS] 【求助】新手求助各位大侠 可以在MS选择中心原子吗~~ (1/644) waitbreeze 2010-09-14 2010-09-14 13:17:22 by ym23
[MS] 【求助】安装MS5.0的操作系统    ( 1 2 ) (10/1670) 眉峰 2010-09-13 2010-09-14 12:55:46 by 眉峰
[MS] 【求助】请大家看看,有红包赠送!一组能带图分析    ( 1 2 ) (14/2414) g_xq96 2010-05-18 2010-09-14 10:53:22 by 思想家
[MS] 【求助】表面吸附我用MS中的castep还是discover    ( 1 2 ) (13/1859) guolianshun 2010-09-11 2010-09-13 19:45:31 by 爱惜花草
[MS] [关贴]【求助】MS-discover 中能量分析的问题 (0/305) qflp 2010-09-13 2010-09-13 16:24:25 by qflp
[MS] 【求助】甲醇水蒸气制氢和甲醇液相制氢有什么区别 (0/293) liujie5631 2010-09-13 2010-09-13 15:59:29 by liujie5631
[MS] 【求助】金属间化合物的腐蚀机理    ( 1 2 ) (10/1866) meimeidyh 2010-05-09 2010-09-13 15:32:17 by ppqq520
[MS] 【求助】原子轨道你和分子轨道求助 (1/356) 562931235 2010-09-13 2010-09-13 14:25:35 by 562931235
[MS] 【求助】利用MS可以计算晶格常数随温度的变化吗?可以结合德拜准谐近似,求方法 (2/438) rechill 2010-09-13 2010-09-13 13:45:18 by rechill
[MS] 【求助】如何获得晶体的各项参数 (2/324) lgl615427 2010-09-13 2010-09-13 12:54:06 by michael1883
[MS] [关贴]【求助】稀土元素Y在镍基表面是否偏聚!! (0/178) liang7035 2010-09-13 2010-09-13 10:53:07 by liang7035
[MS] 【求助】弹性常数问题 (2/683) Huanhuan5360 2010-09-13 2010-09-13 10:02:42 by 锐利的碎片
[MS] 【求助】CASTEP结构优化分数坐标大于一,可能吗? (3/617) babaleo 2010-09-08 2010-09-13 07:58:06 by babaleo
[MS] 【求助】请问大家谁遇到过这样的问题,MS安装之后无法使用量键长键角的工具。送20个金 (3/1221) stefsui 2010-09-11 2010-09-12 22:36:13 by stefsui
[MS] 【求助】MS计算图像怎么输出出来呢 (6/1023) zhanglx8632 2010-09-12 2010-09-12 20:36:50 by yindeqiang
[MS] [关贴]【分享】MS 计算的硬件问题 (评阅-2) (1/290) sss3012 2010-09-12 2010-09-12 20:36:39 by lbambool
[MS] 【求助】materials studio可以run,但是run完后不能分析,这是怎么回事啊? (0/755) fujishima 2010-09-12 2010-09-12 02:05:20 by fujishima
[MS] 【求助】MS和abinit中PDOS的计算原理一样吗? (5/1253) lzl8181 2010-09-08 2010-09-11 18:03:13 by lzl8181
[MS] 【求助】关于ms如何看各个原子的DOS图? (1/509) davidyow 2010-09-11 2010-09-11 16:44:46 by zhangjunkai
[MS] 【求助】金属氧化物掺杂过渡金属的优化 (3/1061) 百合绘梦 2010-07-04 2010-09-11 16:05:00 by guolianshun
[MS] 【求助】从能带图看是否为绝缘体 (2/691) wpwei 2010-09-11 2010-09-11 15:15:22 by ym23
[MS] 【求助】纳米管的周期长度多长合适? (5/1038) ym23 2010-09-10 2010-09-11 11:13:32 by ym23
[MS] 【求助】CASTEP计算数据下载不下来是什么原因呢? (1/440) zhanglx8632 2010-09-11 2010-09-11 11:04:10 by ym23
[MS] 【求助】MS 晶体构造 (0/203) nihaifang- 2010-09-11 2010-09-11 10:47:09 by nihaifang-
[MS] 【求助】CASTEP计算 (5/1316) 花痴8621 2010-06-10 2010-09-11 10:30:13 by guolianshun
[MS] 【求助】用CASTEP 做IR计算时,出现错误 (评阅+1) (8/1850) zhanping 2010-09-07 2010-09-11 09:55:11 by zhanping
[MS] [关贴]【求助】优化过程中参数无变化 (5/450) guolianshun 2010-09-10 2010-09-11 08:58:52 by guolianshun
[MS] 【求助成功】MS 画电荷密度图时,怎么调整刻度标尺的位置 (3/2034) xh512 2010-09-10 2010-09-10 22:45:09 by feass2
[MS] 【求助】奇怪--CASTEP计算遇到的一个现象 (评阅+1) (8/1080) zhanglx8632 2010-09-06 2010-09-10 21:23:04 by zhanglx8632
相关版块跳转
查看