24小时热门版块排行榜    

管理团队 (金币库 94062.1 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

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] 同年申请2项不同项目,第1个项目里不写第2个项目的信息,可以吗 hitsdu 2026-02-11 刚刚
[MS] 【求助】过渡态搜索失败怎么办? (0/781) charityqi 2010-08-30 2010-08-30 22:08:25 by charityqi
[MS] 【求助】MS安装 (5/688) guolianshun 2010-08-30 2010-08-30 19:38:39 by erylingjet
[MS] 【求助】过渡族金属优化问题 (3/602) houfeifan 2010-08-27 2010-08-30 08:08:59 by houfeifan
[MS] 【求助成功】MS5.0的文件隐藏问题 (6/541) ter20 2010-08-24 2010-08-29 22:38:34 by ter20
[MS] 【求助】MS表面建模时UV矢量不能修改 (2/1255) lgxyz 2010-08-28 2010-08-29 08:34:27 by lgxyz
[MS] 【求助】表面模型上impose symmetry的问题 (0/677) houfeifan 2010-08-25 2010-08-28 16:06:55 by houfeifan
[MS] 【求助】castep参数选择问题 (0/241) luobenhua 2010-08-26 2010-08-28 16:06:41 by luobenhua
[MS] [关贴]【求助】卟啉吸附的文章 (0/175) guolianshun 2010-08-27 2010-08-28 16:05:49 by guolianshun
[MS] 【求助】BSSE分析 (0/313) pengge 2010-08-28 2010-08-28 16:05:38 by pengge
[MS] 【求助】DMOL运行了半个多小时还没有完? (8/841) yuansonghu2004 2010-08-27 2010-08-28 07:57:08 by sciencemaji
[MS] 【求助】Castep计算越来越慢 (4/639) newton3915 2010-08-27 2010-08-28 07:51:01 by sciencemaji
[MS] 【求助】合金模型的建立 (1/261) longchang 2010-08-27 2010-08-27 12:41:04 by iamkz
[MS] [关贴]【分享】动力学计算缺陷扩散 (评阅-2) (7/1175) jieweiwei 2010-04-04 2010-08-26 07:58:25 by iamkz
[MS] 【求助】悬键加氢问题 (5/974) houfeifan 2010-08-25 2010-08-25 23:40:32 by 水座
[MS] 【求助】DMol 画pdos在费米面附近选的点太少怎么办 (2/451) helloimet 2009-12-31 2010-08-25 23:20:50 by 天棚元帅
[MS] 【求助成功】启动Material studio 5出错,请教 (6/1791) doveyu 2010-08-21 2010-08-25 21:19:42 by doveyu
[MS] 【求助】CPU运算效率低 (4/718) michael1883 2010-08-25 2010-08-25 16:18:31 by michael1883
[MS] 【求助】帮忙翻译一下 (7/754) 562931235 2010-08-10 2010-08-25 15:30:56 by calos818
[MS] 【求助】optical property 算完分析的时候view 怎么是灰色的 (4/528) btvipvip 2010-08-23 2010-08-25 15:22:37 by dyh753357
[MS] 【求助】CASTEP优化过程变慢 (4/965) houfeifan 2010-08-24 2010-08-25 15:10:27 by wangla
[MS] 【求助】MS4.4和MS5.0的比较!! (2/721) hzfish 2010-08-25 2010-08-25 14:55:35 by sars518
[MS] 【求助】dmol过渡态搜索 (4/832) charityqi 2010-08-18 2010-08-25 11:42:52 by charityqi
[MS] 【求助】DMOL 构建簇模型如何添加点电荷来消除边界效应    ( 1 2 ) (15/1956) 水月慧心 2010-08-23 2010-08-25 09:42:23 by 石油黑人
[MS] 【求助】金属钽的能带和DOS看不懂也,请教了。    ( 1 2 ) (11/1461) 鲤鱼飞 2010-08-24 2010-08-24 21:42:28 by 鲤鱼飞
[MS] 【求助】MIT的Atomistic Computer Modeling of Materials,怎么下载? (2/510) zhaowh1987 2010-08-24 2010-08-24 21:03:08 by qasd
[MS] 【求助】糖类复合材料的力场选择 (1/296) siga5609 2010-08-24 2010-08-24 20:55:12 by qasd
[MS] 【求助】请高手帮忙看看! (7/1086) g_xq96 2010-04-20 2010-08-24 15:45:17 by congliang163
[MS] 【求助】请问用Materials Studio怎样算多壁碳纳米管的能带? (4/1027) g_xq96 2010-04-02 2010-08-24 15:39:49 by congliang163
[MS] 【求助】molecular docking    ( 1 2 ) (19/1759) 天下枫叶 2010-08-23 2010-08-24 13:33:02 by 天下枫叶
[MS] 【求助】DMOL-中计算出的DOS图的都是上下对称的,根本没法用,求和我相同遭遇的人给我 (7/1136) qqfly2003 2010-08-21 2010-08-24 08:35:16 by qqfly2003
[MS] 【求助】请问有谁做过population analysis,NiAs结构中有多少个键 (3/730) wzh上善若水 2010-08-17 2010-08-24 07:49:18 by xyzzz986
[MS] 【求助】castep计算声子谱 (3/1369) newton3915 2010-08-23 2010-08-23 11:00:35 by xirainbow
[MS] 【求助】晶包的问题 (3/587) wanfei 2010-08-22 2010-08-23 10:55:20 by wanfei
[MS] 【求助】MS 如何算提模量,杨氏模量和声速等力学性质? (1/1590) ym23 2010-08-23 2010-08-23 09:41:05 by zzy870720z
[MS] 【求助】研究无定形体系的软件 (4/428) xuexue9990 2010-07-24 2010-08-23 02:30:50 by zyj8119
[MS] 【求助】结构绘制 (2/228) 天下枫叶 2010-08-22 2010-08-22 21:37:17 by 天下枫叶
[MS] 【求助】MS中,反铁磁表面吸附小分子的计算 (1/772) 宏hong 2010-07-19 2010-08-22 20:27:11 by 宏hong
[MS] 【求助】Materials-studio做出的结果能否发表 (9/1499) laidaohui 2010-08-21 2010-08-21 22:49:02 by lwrobinson
[MS] [关贴]【求助】recleave,rebuild,什么时候用什么时候不用啊 (3/297) guolianshun 2010-08-21 2010-08-21 22:41:36 by cenwanglai
[MS] 【求助】聚合物的耐磨性的验证方法 (0/226) l253589424 2010-08-20 2010-08-21 20:45:49 by l253589424
[MS] 【求助】怎么算周期性结构的轨道电子密度 (0/305) wanwanq 2010-08-20 2010-08-21 20:45:26 by wanwanq
[MS] 【求助】Ms中Rietveld精修的问题 (0/755) 江海寄余生 2010-08-21 2010-08-21 20:45:06 by 江海寄余生
[MS] 【求助】金纳米空球 (1/271) wanfei 2010-08-19 2010-08-21 17:11:18 by wanfei
[MS] 【求助】castep计算出现停止现象。请求高手。 (3/928) liwangchan 2010-08-18 2010-08-20 21:53:27 by yindeqiang
[MS] 【求助】晶体硬度在CASTEP下的计算 (4/1207) wzh上善若水 2010-07-21 2010-08-20 20:08:21 by lichangchen
[MS] [专家] 【求助】向大家咨询一下,第一性原理计算氢键的一些性质怎么算? (2/283) dxcharlary 2010-08-14 2010-08-20 18:49:08 by dxcharlary
[MS] 【求助】这样是否可以删掉K、I原子投入计算 (2/291) gsp99 2010-08-20 2010-08-20 18:02:39 by Hector8275
[MS] [关贴]【求助】MS3D页面分子不能移动也不能旋转定格了 (4/876) guolianshun 2010-08-19 2010-08-20 10:23:30 by zzy870720z
[MS] 【求助】linux下 MS 提交作业 不能指定多个CPU (7/1295) lxjuan 2010-08-19 2010-08-20 09:32:21 by lxjuan
[MS] 【其他】根据什么选择的结构优化的标准    ( 1 2 ) (11/636) Hector8275 2010-08-18 2010-08-19 16:59:50 by Hector8275
[MS] 【求助】+U的设置 (1/631) lguanl 2010-08-19 2010-08-19 13:38:34 by cenwanglai
[MS] 【求助】CASTEP计算出的能带图的k点在origin中如何处理啊 (6/2116) wzh上善若水 2010-08-12 2010-08-19 09:45:33 by cenwanglai
[MS] [关贴]【求助】卟啉吸附二氧化钛表面模型的建立有会的吗 (3/369) guolianshun 2010-08-16 2010-08-19 09:21:59 by guolianshun
[MS] 【求助】关于DMol3中的收敛问题?? (2/979) xbb421987 2010-07-24 2010-08-19 09:02:45 by sciencemaji
[MS] 【其他】晶格畸变,一起DOS图中peak的扩宽,是否具有普遍性? (0/193) xbb421987 2010-08-19 2010-08-19 08:37:58 by xbb421987
[MS] 【求助】算磁性,求Fe原子U值。 (5/1123) gongjijun 2010-07-30 2010-08-18 16:48:54 by sciencemaji
[MS] 【求助】表面模型优化问题 (1/422) houfeifan 2010-08-18 2010-08-18 15:44:21 by houfeifan
[MS] 【求助】怎么计算氮原子能量    ( 1 2 ) (10/1699) yuandi1979 2010-08-16 2010-08-18 15:30:17 by yuandi1979
[MS] 【求助】dmol的电子密度图为什么这样 (1/280) lwei7336 2010-08-12 2010-08-18 15:04:32 by lwei7336
[MS] 【求助】关于两种晶体的固溶 (2/306) luoye8885 2010-08-08 2010-08-18 10:42:12 by 锐利的碎片
[MS] 【求助】程序失败!! (2/521) astrolia 2010-08-17 2010-08-18 10:23:39 by astrolia
[MS] 【求助】收敛问题 (9/1293) piao2004ha 2010-07-27 2010-08-18 10:06:52 by sunyang1988
[MS] 【求助】如何用MS软件构建TiO2纳米管 (1/711) lybzyt 2010-08-04 2010-08-18 09:32:17 by xintom
[MS] 【求助】文件不能运行,这是什么问题呢    ( 1 2 ) (10/952) charityqi 2010-08-16 2010-08-18 08:35:49 by charityqi
[MS] 【求助】在MS里,如何在一个晶胞里加入一个分子 (3/1415) shiyanshi2 2010-08-11 2010-08-17 16:33:53 by enola
[MS] 【求助】分子模拟中的,退火问题 (2/924) cocoling 2010-08-08 2010-08-17 15:10:59 by dickli2008
[MS] 【求助】MS中的退火问题 (评阅+1) (1/1717) cocoling 2010-08-13 2010-08-17 15:06:57 by dickli2008
[MS] 【求助】体系能带整体下移说明了什么? (3/859) fangyongxinxi 2010-08-14 2010-08-16 11:25:19 by hgye
[MS] 【求助】castep 算能量随K点的变化关系 (8/1066) btvipvip 2010-08-15 2010-08-15 21:35:30 by btvipvip
[MS] 【求助】氧分子怎么构建和计算能量 (1/520) yuandi1979 2010-08-15 2010-08-15 15:02:55 by houfeifan
[MS] 【求助】Linux 安装 (2/610) ruibinjiang 2010-08-15 2010-08-15 12:51:24 by zzy870720z
[MS] 【求助】Castep中的波函数 (1/499) lzl8181 2010-08-15 2010-08-15 11:21:50 by condensed
[MS] 【求助】表面模型优化失败 (2/589) houfeifan 2010-08-14 2010-08-15 08:22:54 by houfeifan
[MS] 【求助】用CASTEP计算金属时如何确定自旋多重度 (2/472) greaticeland 2010-08-14 2010-08-14 21:59:55 by greaticeland
[MS] 【求助】赝势和化学势的区别 (2/753) currentyoungman 2010-08-14 2010-08-14 21:05:26 by xirainbow
[MS] 【求助】计算时出现网络未连接所以不能算怎么回事? (1/254) luguangxia 2010-08-14 2010-08-14 12:11:10 by gongjijun
[MS] 【求助】电荷密度图    ( 1 2 ) (11/1861) 霍萌 2010-05-12 2010-08-13 22:34:54 by guifan
[MS] 【求助】ms 计算金属弹性性质结果与实验值相差太大 (2/404) fangyongxinxi 2010-08-13 2010-08-13 21:44:01 by zxzj05
[MS] 【求助】MS里面按照何种规则进行晶胞和原胞转换的 (7/2925) calos818 2010-08-13 2010-08-13 21:10:55 by beyondstar
[MS] 【求助】为什么YAlO3查了好多资料只有一种结构,应该有很多种的啊? (3/649) yanbowang 2010-08-05 2010-08-13 20:37:38 by yanbowang
[MS] 【求助】表面吸附模型优化问题 (3/824) houfeifan 2010-08-12 2010-08-13 15:59:54 by houfeifan
[MS] 【求助】询问DOML3算出的电子态密度图费米能级问题!    ( 1 2 3 ) (21/2545) kugou521 2010-08-02 2010-08-13 12:37:36 by kugou521
[MS] 【求助成功】晶体规模增大后对导带态密度的影响 (5/965) astrolia 2010-08-11 2010-08-13 10:35:12 by astrolia
[MS] 【求助】CASTEP计算出的能带图如何直接导到word上 (7/1278) wzh上善若水 2010-08-11 2010-08-12 16:35:14 by wzh上善若水
[MS] 【求助】Castep几何优化后求弹性模量。 (0/332) 鲤鱼飞 2010-08-12 2010-08-12 15:57:35 by 鲤鱼飞
[MS] [关贴]【求助】吸附后原子位置的改变是否会影响最后结果! (2/895) liang7035 2010-08-12 2010-08-12 14:38:19 by liang7035
[MS] 【求助】周期性与真空层 (2/656) zmj110 2010-08-12 2010-08-12 11:12:48 by zmj110
[MS] 【求助】MS 5.0 Dmol3如何处理服务器返回的dos,pdos (0/389) vasp001 2010-08-12 2010-08-12 01:56:51 by vasp001
[MS] 【求助】弹性常数 (0/395) liangping3881 2010-08-11 2010-08-11 20:17:13 by liangping3881
[MS] 【求助】MS如何计算某一方向的透过率? (2/254) freshman8185 2010-08-11 2010-08-11 18:29:40 by freshman8185
[MS] 【求助】ms5.0,计算能带结构出现的问题 (2/585) fangyongxinxi 2010-08-05 2010-08-11 13:49:06 by zzy870720z
[MS] 【求助】优化到一半失败却没有结果下载下来 (2/395) astrolia 2010-08-10 2010-08-11 11:51:00 by astrolia
[MS] 【求助】问个问题 (2/224) guolianshun 2010-08-11 2010-08-11 11:33:26 by baihui1986
[MS] 【求助】ms作图问题 (0/378) ramble81 2010-08-10 2010-08-10 21:19:58 by ramble81
[MS] 【求助】Linux系统top命令下面几行意思 win7安装ms (8/1492) lishufei 2010-07-18 2010-08-10 20:35:12 by wuli8
[MS] 【求助】请教一个Linux安装MS5.0 ./Install: 24:出错问题 (5/871) aylayl08 2010-07-20 2010-08-10 20:34:56 by wuli8
[MS] 【求助】自旋极化计算设置的问题 (3/2346) houfeifan 2010-08-09 2010-08-10 00:00:31 by sunyang1988
[MS] 【其他】2G内存 奔腾E5300双核 装MS能跑多少个原子 (5/925) calos818 2010-08-09 2010-08-09 22:58:28 by chensxxy
[MS] 【求助】MS排队计算 (4/384) 静峰 2010-08-08 2010-08-09 15:02:17 by 静峰
相关版块跳转
查看