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[热点] 售SCI一区文章,我:8.O.55.1.O.54,科目齐全,可伽急 Z7qfCsdIiD1T 2026-11-15 刚刚
[MS] 【求助】哪位高手能模拟出晶体的raman光谱啊 (0/281) songbin664 2011-02-24 2011-02-24 14:36:37 by songbin664
[MS] 【求助】高手请看我的MS计算的错误提示,该怎么设定参数来满足要求 (5/1645) dreamboat 2011-02-19 2011-02-24 14:02:53 by dreamboat
[MS] 【求助】如何在已经手动添加原子后,再加上外面那个白box啊? (6/1002) hans201011 2011-02-23 2011-02-24 09:37:20 by bingmou
[MS] 【求助】gama 三氧化二铝的建模参数(许诺五十金币) (8/1954) lggm208 2011-01-17 2011-02-24 09:18:49 by yrx19861111
[MS] 【求助】计算有结果是不是表示已收敛? (8/982) freshman8185 2011-02-19 2011-02-24 09:15:14 by pumf
[MS] 【求助】castep算出能带图中横坐标Γ和X的具体坐标是多少啊?另,石墨稀的带隙宽度为� (2/1278) 李佳佳佳 2011-02-23 2011-02-23 20:09:25 by 李佳佳佳
[MS] [关贴]【求助】求助南京大学物理系——王广厚的论文 (0/329) qqfly2003 2011-02-23 2011-02-23 18:33:33 by qqfly2003
[MS] 【求助】MS中Discover_Dynamics运行时能否加入外界电场呢? (12/1772) 安德 2011-02-21 2011-02-23 16:52:53 by 安德
[MS] 【求助】Doml3用途 (1/795) chdx0618 2011-02-23 2011-02-23 10:19:54 by chdx0618
[MS] 【求助】用DMOL3怎么算钛原子能量 (11/3471) malou 2011-02-18 2011-02-23 10:12:30 by malou
[MS] 【求助】DFT (1/367) mountwar 2011-02-23 2011-02-23 09:14:52 by ellsaking
[MS] 【求助】怎么利用DPD模块模拟聚合物刷? (0/402) wzg33 2011-02-22 2011-02-22 18:43:30 by wzg33
[MS] 【求助】在Castep下按下RUN以后,出现了Method of object failed,该怎么解决。谢谢 (2/522) wy2008szy 2011-02-21 2011-02-22 18:26:09 by souledge
[MS] 【求助】谁有castep的源程序或者说明书帮助文件之类的 (1/449) w2056275 2011-02-22 2011-02-22 10:25:03 by sars518
[MS] 【求助】晶格能global minimum和local minimum (0/287) mountwar 2011-02-21 2011-02-21 21:25:49 by mountwar
[MS] 【求助】关于build一个模型,坐标原点的选择 (1/417) dndxwoaini 2011-02-21 2011-02-21 19:35:35 by dndxwoaini
[MS] 【求助】dmol中怎么画bandstructure (1/496) daochunhan1327 2011-02-21 2011-02-21 15:22:34 by lfzlpd
[MS] 【求助】MS模拟大侠请进 (2/427) gcjane01 2011-02-18 2011-02-21 15:06:22 by gcjane01
[MS] 【求助】polymorph 模块 (3/780) mountwar 2011-02-21 2011-02-21 11:23:08 by ahehyh
[MS] 【求助】小分子在表面分解,首先必须是发生化学吸附? (1/437) jdy19862002 2011-02-18 2011-02-21 00:27:12 by pro_junjie
[MS] 【求助】关于吸附的新手问题。 (1/610) xiaojivan 2011-02-20 2011-02-21 00:13:00 by pro_junjie
[MS] 【求助】能告诉我几个国内计算机模拟的大牛吗? (4/1091) mountwar 2011-02-20 2011-02-20 20:31:38 by zhangguangping
[MS] 【求助】计算固态P的能量,怎么建模? (1/546) kangli8165 2011-02-20 2011-02-20 20:24:41 by pro_junjie
[MS] 【求助】问个关于ms模拟界面的问题    ( 1 2 ) (18/2440) songbin664 2009-08-09 2011-02-20 14:52:40 by xk6891
[MS] 【求助】为什么MS中总是出现打开clipboard失败 (0/246) yiran10 2011-02-20 2011-02-20 14:51:46 by yiran10
[MS] 【求助】知道这些数据之后如何在MS中建模?    ( 1 2 ) (13/2702) cuimingshan 2010-10-14 2011-02-20 14:49:04 by qli0218
[MS] 【求助】求助文献翻译,有一句话不知该如何正确的翻译 (1/352) qqfly2003 2011-02-20 2011-02-20 14:04:40 by hbhehe
[MS] 【求助】关于MS技术方面的求助! (3/803) 安德 2011-02-18 2011-02-19 21:57:49 by li5237001
[MS] 【求助】这样的电荷密度有没有意义 (1/506) g_xq96 2011-02-18 2011-02-19 16:44:01 by bingmou
[MS] 【求助】应力应变曲线 得到材料抗拉强度问题 (1/1730) 随心意 2011-02-18 2011-02-19 10:29:27 by babaleo
[MS] 【求助】限制一起被复制了吗? (6/703) 5858797 2011-01-13 2011-02-19 10:12:22 by hh19850402
[MS] 【求助】“access denied” 无法读取模型文件 (7/1384) ym23 2011-02-16 2011-02-18 10:14:37 by ym23
[MS] 【求助】关于ms软件的计算需要多少个核 (3/1762) charityqi 2011-02-16 2011-02-18 09:43:40 by qasd
[MS] 【求助】请哪位解释下固定磁矩法如何实现(fixed-spin-moment)? (2/766) 风萧萧栖 2010-10-21 2011-02-17 08:02:28 by identation
[MS] 【求助成功】沸石孔洞分析 (4/842) alphawei 2011-01-26 2011-02-16 21:26:29 by alphawei
[MS] 【求助】DMol3建立真空层后优化的问题 (2/698) xiaojivan 2011-02-16 2011-02-16 11:31:26 by xiaojivan
[MS] [关贴]【求助】混乱结构怎么建模 (16/1346) dreamboat 2011-01-24 2011-02-15 17:41:08 by frank_zhan
[MS] 【求助】求助-ms中的总能量 (1/1017) liangziguangxue 2011-02-10 2011-02-14 21:37:52 by 尹珺加油
[MS] 【求助】linux算完了怎么出图呀? (4/486) zhenfeili 2011-02-14 2011-02-14 16:54:22 by bingmou
[MS] 【转帖】如何分析第一原理的计算结果 (评阅+1) (8/1618) guolianshun 2010-09-26 2011-02-13 11:57:00 by sg18408926
[MS] 【求助】ms5.5 安装 (1/631) 2wang 2011-02-11 2011-02-12 21:51:20 by 501enya
[MS] 【求助成功】DOS命令进行批处理出现“HP-HPI licensed for Accelrys.” (4/937) xdr 2011-02-11 2011-02-12 18:40:03 by xdr
[MS] 【求助】赝势的选取问题! (9/2593) jiaozy 2011-01-19 2011-02-12 13:41:07 by freshman8185
[MS] 【求助】castep 金属Sc和苯环的配合自旋计算问题 (4/878) cf666 2011-01-15 2011-02-08 16:38:13 by boylc789
[MS] 【求助】去掉对称性算几何优化的话,,原胞和晶胞算的结果一样吗 (4/1043) lishourui111 2010-12-10 2011-02-07 13:49:36 by 尹珺加油
[MS] 【求助】自旋设置问题 (2/533) houfeifan 2010-12-11 2011-02-07 13:48:43 by 尹珺加油
[MS] 【求助】请问各位大侠关于能带图和半导体物理的问题 (2/672) ahu1221 2010-12-22 2011-02-07 13:45:15 by 尹珺加油
[MS] 【求助】castep中的GGA+U和LDA+U问题? (1/564) freshman8185 2011-01-13 2011-02-07 13:20:35 by 尹珺加油
[MS] 【求助】如何分析能带和DOS图    ( 1 2 ) (10/4523) jgq880125 2010-11-25 2011-02-07 13:19:03 by 尹珺加油
[MS] 【求助】CASTEP中可以实现GGA+U算法吗 (6/1991) Julie9563 2011-01-13 2011-02-07 13:16:11 by 尹珺加油
[MS] 【求助】如何分析原子s轨道或p轨道贡献大小的原因? (4/1838) astrolia 2011-01-20 2011-02-07 13:10:26 by 尹珺加油
[MS] 【求助】怎样在Ni(111)上建(根号7X根号7)R30°的复杂单胞 (0/505) zcntydyd 2011-02-07 2011-02-07 10:58:37 by zcntydyd
[MS] 【求助】ms5.5 licence for linux (2/417) gaussian08 2011-01-26 2011-02-07 10:14:00 by guohuazhong
[MS] 【求助】SORPTION如何模拟脱附曲线 (1/409) sunzhiguo 2011-01-13 2011-02-02 12:12:52 by zyj8119
[MS] 【其他】MS构建晶体结构 (5/1375) yeahnet 2011-01-20 2011-02-01 19:18:55 by ellsaking
[MS] 【求助】求个能下的MS 5.0或者5.5下载链接 (1/456) zhongde100 2011-01-30 2011-01-30 18:45:21 by zzy870720z
[MS] 【求助】求Beta-Cu2S晶胞原子分数坐标 (6/1738) zcntydyd 2011-01-27 2011-01-30 09:56:48 by zcntydyd
[MS] 【求助】关于表面disordered结构的建模 (7/981) frank_zhan 2011-01-26 2011-01-30 00:05:53 by sunyang1988
[MS] 【求助】CIF中的atom_site_occupancy值小于1的意义是什么? (3/2225) zcntydyd 2011-01-28 2011-01-29 10:48:24 by zcntydyd
[MS] 【求助】求 CuS 晶体结构原子坐标 (4/2588) dingwei8108 2011-01-24 2011-01-28 09:55:09 by fu19871111
[MS] 【求助】求Cu2S 晶体结构原子坐标 (0/265) zcntydyd 2011-01-27 2011-01-27 09:59:34 by zcntydyd
[MS] 【求助】Sorption这种情况下该采用什么力场 (1/381) sunzhiguo 2010-12-23 2011-01-26 22:31:40 by alphawei
[MS] 【求助】MS5.5 castep 求助 (2/559) longwangye 2011-01-25 2011-01-26 20:15:36 by longwangye
[MS] 【求助】急:Ni(111)面上怎样用ms建个(根号7X根号7)R30°的单胞 (0/558) zcntydyd 2011-01-26 2011-01-26 13:34:16 by zcntydyd
[MS] 【求助】MS5.5 计算PDOS问题 (2/533) aliceyu 2011-01-25 2011-01-26 10:25:23 by aliceyu
[MS] 【求助】Ni(111)-sqrt(7)*sqrt(7)R19degree单胞怎么构建 (0/291) zcntydyd 2011-01-26 2011-01-26 10:04:59 by zcntydyd
[MS] 【求助】用DMol3能否模拟催化反应,温度在哪里设置? (3/1775) xiaojivan 2011-01-20 2011-01-25 23:50:35 by charityqi
[MS] 【求助】关于castep中力的测试! (0/286) didi5158 2011-01-23 2011-01-25 09:16:17 by didi5158
[MS] 【求助】结构优化是的问题 (7/2202) wydzyx2003 2011-01-19 2011-01-25 06:25:06 by qphll
[MS] [关贴]【求助】审稿人的这两个问题怎么回答 (2/918) Julie9563 2011-01-23 2011-01-23 21:54:37 by smilehhm
[MS] 【求助】castep计算应力应变曲线结果文件中的两个stress tensor (5/3993) wanglianli136 2010-01-06 2011-01-23 21:42:47 by 25351048
[MS] 【求助】怎样找castep结果中的原子位置 (0/351) 随心意 2011-01-22 2011-01-22 15:12:19 by 随心意
[MS] 【求助】如何设置网络回环啊 (15/3108) 水之源 2011-01-18 2011-01-22 14:07:54 by lbambool
[MS] 【求助】castep 搜索过渡态成功后,怎样确认这个过渡态是正确的? (6/3069) jdy19862002 2010-12-31 2011-01-22 10:33:21 by jdy19862002
[MS] 【求助】DMOL优化构型 (0/278) xiaoboy185 2011-01-21 2011-01-21 16:53:33 by xiaoboy185
[MS] 【求助】spin density (2/643) dlthl 2011-01-11 2011-01-20 20:58:30 by goldenfisher
[MS] 【求助】castep 光学性质计算    ( 1 2 ) (18/2864) spur 2011-01-10 2011-01-20 19:00:12 by awmc2008
[MS] 【其他】MS打开cif文件 (1/1980) myyeah123 2011-01-20 2011-01-20 18:39:45 by xianggui7895
[MS] 【求助】错误提示 (1/601) zhenfeili 2011-01-20 2011-01-20 13:10:23 by zzy870720z
[MS] 【求助】物理吸附的态密度图 (5/2415) liujie5631 2011-01-19 2011-01-20 10:51:18 by hakuna
[MS] 【求助】银团簇结构用MS分析 (0/457) liuzhun168 2011-01-19 2011-01-19 11:47:57 by liuzhun168
[MS] 【求助】大家用DMOL3算的C60分子的LUMO-HOMO带隙是多少啊? (8/2561) piii700 2011-01-18 2011-01-19 09:53:11 by piii700
[MS] 【求助】求助 MS 原子占位问题 (6/1931) dingwei8108 2011-01-14 2011-01-18 20:05:49 by dingwei8108
[MS] 【讨论】关于缺陷形成能 (5/2205) 学员H1RkcJ 2009-12-18 2011-01-18 17:00:01 by black_leopard
[MS] 【求助】磁性计算 (3/711) aliceyu 2011-01-18 2011-01-18 12:32:44 by aliceyu
[MS] 【求助】获得配位数的软件 (评阅+1) (4/1171) mjjwhs 2010-09-07 2011-01-18 11:08:57 by amynihao
[MS] 【求助成功】RDF (5/1455) mountwar 2011-01-17 2011-01-18 10:03:39 by mountwar
[MS] 【求助】如何才能成功优化表面模型?? (0/243) clszxh02 2011-01-17 2011-01-17 23:45:06 by clszxh02
[MS] 【求助】关于cell amorphous (0/348) mountwar 2011-01-17 2011-01-17 19:43:24 by mountwar
[MS] 【求助】ms里如何修改氢键的颜色和形式(直径大小,虚实线)? (0/1676) tonytony823 2011-01-17 2011-01-17 16:36:40 by tonytony823
[MS] 【求助】castep问题 (5/1336) Janboma 2010-09-19 2011-01-17 15:52:32 by mjjwhs
[MS] 【求助】求助 B sheet and nanotube 的晶体结构 (5/567) xiaoboy185 2011-01-07 2011-01-17 13:07:32 by xiaoboy185
[MS] 【求助】如何将gjf文件导入到MS中 (5/893) xiaoboy185 2011-01-17 2011-01-17 13:07:16 by xiaoboy185
[MS] 【求助】CASTEP结构优化轨迹文件FrameEnergy的疑问 (1/493) xianggui7895 2011-01-16 2011-01-16 19:44:23 by xianggui7895
[MS] 【求助】2008sever系统下装不上MS5.5?急求助 (7/568) shelay 2011-01-05 2011-01-16 10:05:17 by shelay
[MS] 【求助】MS一断网计算就出错。。。 (7/1183) freshman8185 2011-01-14 2011-01-16 00:27:19 by souledge
[MS] 【求助】关于MS中用于高分子的模块问题 (0/430) champion939 2011-01-15 2011-01-15 23:07:23 by champion939
[MS] 【求助】怎样在晶胞中C-C单键的位置添加一苯环 (4/903) hjlyyc 2011-01-11 2011-01-15 22:08:33 by hjlyyc
[MS] 【求助】请问高手,castep计算后,态密度图和波函数图怎么取得啊? (2/579) tdne1984 2011-01-15 2011-01-15 12:23:16 by xianggui7895
[MS] 【求助】Materials Studio 5.0 linux license安装出问题了 (3/2214) suyi20466975 2010-10-16 2011-01-14 23:04:36 by gszdj3699609
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