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[热点] 面上项目申报 Tide man 2026-02-08 刚刚
[MS] [已完结]请教有关DMOL3的设置问题    ( 1 2 ) (评阅+1) (1ST强帖+1)(10/3960) yuhuashi1 2011-07-03 2013-03-04 15:25:35 by 与狼共舞701
[MS] [已完结]计算过程中出现问题 (2/220) yolanda1234 2013-03-01 2013-03-04 10:12:36 by miao968
[MS] [已完结]kohn-sham方程怎么展开的 (2/1430) scq123 2013-02-28 2013-03-04 09:06:05 by scq123
[MS] 弹性常数的计算    ( 1 2 ) (12/3328) npuouwen 2013-02-20 2013-03-03 10:54:00 by npuouwen
[MS] [已完结]有用MS做KTN晶体掺杂的么?求交流··· (1/277) hitwzx 2013-03-01 2013-03-03 10:40:09 by hitwzx
[MS] [已完结]CASTEP过渡态搜索,过渡态能量很高,怎么办?    ( 1 2 ) (18/2477) gexincumt 2013-02-27 2013-03-02 14:16:11 by Lathander
[MS] [已完结]气体在聚合体扩散系数问题 (0/277) windy1991 2013-03-01 2013-03-01 21:50:18 by windy1991
[MS] [已完结][关贴]计算结果相差太大 (2/792) xiao9xie 2013-03-01 2013-03-01 16:41:17 by zal7891
[MS] [已完结]什么性能由晶格常数决定呢? (0/1087) ym23 2013-03-01 2013-03-01 11:43:55 by ym23
[MS] [已完结]求助Material Studio 5.5 的License无法安装或者求一个license (1/400) g_wei 2013-02-28 2013-02-28 18:44:50 by dbw1900
[MS] 【求助】如何在晶体中掺杂 (4/1303) chdx0618 2011-02-04 2013-02-28 17:40:01 by yujingui
[MS] [已完结]关于碳酸钾催化反应的体系 用什么模块来计算? (1/339) 慢三儿 2012-11-27 2013-02-28 14:54:41 by stella302020
[MS] [已完结]求助: 用castep计算非周期结构有什么要注意的? (0/356) 搁浅五千年 2013-02-28 2013-02-28 12:56:21 by 搁浅五千年
[MS] [已完结]高温金属材料 (0/223) wuxifeng 2013-02-28 2013-02-28 11:02:05 by wuxifeng
[MS] [已完结]Castep中Spin polarized计算时Initial spin怎么设置? (2/755) lzn_t 2013-02-27 2013-02-28 08:48:53 by 梦@君
[MS] [已完结]MS的SORPTION 模块探究碳纳米管对气体的吸附问题(急啊,忘高手解答) (2/858) 独钓寒江雪。 2013-02-27 2013-02-27 19:22:55 by acterjie
[MS] [已完结]如何在MS中改变一个晶胞中的碳纳米管距离(急急急) (3/1673) 独钓寒江雪。 2013-02-26 2013-02-27 12:49:08 by 独钓寒江雪。
[MS] [已完结]能带计算是计算不成功咋回事? (3/919) 桥上人 2013-02-26 2013-02-27 10:58:47 by 桥上人
[MS] 【求助】求问一个STM profile不能显示的问题 (6/1342) flymice 2010-11-24 2013-02-27 05:45:21 by 水中波纹
[MS] [已完结]ms5.5安装问题 (7/893) 菲顶顶 2012-08-27 2013-02-26 13:48:29 by 729267452lgl
[MS] [已完结]计算时间菜鸟问题 (5/517) yolanda1234 2013-02-25 2013-02-26 08:33:49 by 729267452lgl
[MS] [已完结]弹性常数的经验值 (0/295) haitian123 2013-02-25 2013-02-25 15:24:03 by haitian123
[MS] [已完结]想请教各位能线图用什么软件画的? (1/1235) gexincumt 2013-02-25 2013-02-25 13:40:02 by 书万里
[MS] [已完结]MS软件如何导入GAUSSIAN计算获得的原子电荷数据? (0/807) cg陈 2013-02-24 2013-02-24 20:01:09 by cg陈
[MS] [已完结]关于轨道杂化的问题 (5/1007) jinzhulin000 2013-02-23 2013-02-24 17:40:02 by 275560060
[MS] [已完结][关贴]求用materials studio能计算一个设定的二面角与分子总能量的变化曲线吗?金币可追加! (2/1022) yongbinz 2013-01-24 2013-02-20 22:03:07 by vasp001
[MS] [已完结]【求助】materials studio5.5 for linux单点计算没问题,一并行就出错,没有错误日志 (2/306) kk101294 2012-08-26 2013-02-20 19:01:23 by vasp001
[MS] 【求助】MS计算能带后,禁带宽度只能用眼定性看么?在哪能看到数值到底是多少? (7/1392) tonyliu0401 2010-11-23 2013-02-19 19:33:12 by xxjiang
[MS] [已完结]MS 打开时出现问题 cannot find licensing library (5/2246) wondersylar 2013-02-19 2013-02-19 10:28:55 by wondersylar
[MS] 谁算过稀土材料啊 (8/777) 芒果茶 2013-01-24 2013-02-18 21:19:41 by liuny
[MS] Mac系统能否安装Materials studio linux版本? (29/9293) hjlyyc 2013-02-14 2013-02-18 14:28:02 by xztxy
[MS] [已完结]声子计算的两种方法的区别? (0/326) gyj2058034 2013-02-17 2013-02-17 22:49:12 by gyj2058034
[MS] [已完结]求文献Ab initio study of oxygen-vacancy LaAlO3(001) surface,Chinese Phys. B (1/210) 429078972 2013-02-17 2013-02-17 16:21:01 by guohuazhon
[MS] [已完结]软磁材料组织 (0/358) 谜样渣化君 2013-02-16 2013-02-16 21:57:37 by 谜样渣化君
[MS] [已完结]如何建立界面 (1/310) 搁浅五千年 2013-02-04 2013-02-15 21:30:49 by 白小狼wolf
[MS] [已完结][关贴]请大家帮忙看看MS为何不能将结果下载下来 (0/779) lorna639 2013-02-13 2013-02-13 21:32:05 by lorna639
[MS] [已完结]Indium的结合能 (2/227) wenhualuo 2013-02-08 2013-02-08 19:38:44 by wenhualuo
[MS] [已完结]MS 中的CASTEP可以计算强关联体系的晶体结构(如VO2)吗? (7/2147) zzjzjnb 2011-05-16 2013-02-08 07:44:29 by Lathander
[MS] [已完结]高压对布局值的影响 (0/136) hwceng0816 2013-02-08 2013-02-08 07:15:25 by hwceng0816
[MS] 光学性能频率范围设置 (0/325) cast510 2013-02-07 2013-02-07 07:33:18 by cast510
[MS] 【求助】MS作环糊精与小分子的作用,小分子不进环 (5/703) swordboy1980 2010-04-21 2013-02-06 14:42:11 by xiongxy
[MS] [已完结]求MS5.0及windows下license (3/662) zcq90 2013-02-02 2013-02-05 10:08:56 by zxynepu
[MS] [已完结]利用MS如何寻找ZnO的特殊K点 (2/1394) yangfeng513 2013-02-03 2013-02-04 10:18:48 by yangfeng513
[MS] 【求助】CASTEP MPI 运行错误 (6/2064) saikun 2011-01-21 2013-02-03 23:10:35 by vasp001
[MS] [已完结]第一性原理高压计算投什么期刊? (4/497) hwceng0816 2013-02-02 2013-02-03 14:09:29 by hwceng0816
[MS] [已完结]如何用MS构造金属表面吸附大分子结构 (5/1388) zhangyunli 2013-01-26 2013-02-03 10:19:48 by zhangyunli
[MS] [已完结]稀土化合物加U计算 (4/831) hwceng0816 2013-01-26 2013-02-02 20:01:54 by 提供稀土小样
[MS] 请高手帮忙:Castep 运行中途不再打点了 (2/253) ping888 2013-02-02 2013-02-02 19:43:35 by ping888
[MS] [已完结]交换关联势 (0/1304) hwceng0816 2013-02-01 2013-02-01 19:44:28 by hwceng0816
[MS] dol3模块进行结构优化计算时出现这种情况该怎么解决?(注意看图,谢谢) (6/896) huangzhfen 2013-01-29 2013-02-01 15:55:03 by huangzhfen
[MS] [已完结]关于晶体结构确定的问题? (0/331) chenxin1992 2013-02-01 2013-02-01 13:34:39 by chenxin1992
[MS] [已完结]DMOL3运行出现的问题 (0/311) synu 2013-01-31 2013-01-31 11:21:46 by synu
[MS] [已完结]Materials studio 不能粘贴小分子,求指导 (0/738) k_now 2013-01-30 2013-01-30 17:27:35 by k_now
[MS] [已完结]castep几何优化与势垒    ( 1 2 ) (13/1555) gll329748327 2012-11-22 2013-01-30 15:27:06 by gll329748327
[MS] Cu2O讨论 (20/1062) pingshj 2013-01-26 2013-01-30 12:07:37 by Lathander
[MS] [已完结]Redefine lattice (0/2361) benzscu 2013-01-29 2013-01-29 22:37:01 by benzscu
[MS] 【求助】为团簇建晶格模型问题 (8/1674) lwei7336 2010-04-28 2013-01-28 09:49:14 by hn19870519
[MS] 晶体中内层电子的能级是否发生劈裂,变为连续能带? (8/1607) bandgap 2013-01-27 2013-01-28 04:33:32 by bandgap
[MS] 【求助】请问研究O2,CO等小分子在表面的吸附和化学反应,采用哪个模块更合适? (8/1636) tranquilseaside 2010-10-08 2013-01-27 18:48:09 by zuozhijun5134
[MS] [已完结]电子由电负性大的原子转移到了电负性小的原子上,对嘛? (7/2091) nnwang 2012-03-26 2013-01-27 18:17:04 by zyoypx
[MS] [已完结]反铁磁怎么优化后成了铁磁    ( 1 2 ) (12/1626) 芒果茶 2013-01-22 2013-01-27 15:09:27 by Lathander
[MS] [已完结]关于Fe110面的最稳定吸附位置 (7/1353) luoluoasdf 2012-09-06 2013-01-26 18:43:15 by 707462558
[MS] [已完结]DOS的问题 (8/662) fanqy1991 2013-01-23 2013-01-25 15:07:34 by mlanqiang
[MS] [已完结]100金币求在linux下安装MS6.0 (0/292) tuhonghao 2013-01-25 2013-01-25 13:17:03 by tuhonghao
[MS] [已完结]团簇建晶格模型时团簇位置的问题 (3/738) windy1991 2013-01-24 2013-01-25 08:34:24 by zhangml_2000
[MS] [已完结]请教几个和ZnO能带有关的概念 (0/271) qlpsw12 2013-01-24 2013-01-24 15:43:34 by qlpsw12
[MS] [已完结]在win7装MS4.4时license出现问题,请各位虫友帮忙指点! (2/279) 大草原 2013-01-22 2013-01-23 19:04:45 by 大草原
[MS] [已完结]怎么向Gridview计算平台提交任务 castep (0/745) 与狼共舞701 2013-01-23 2013-01-23 16:39:47 by 与狼共舞701
[MS] 【求助】castep向服务器提交作业    ( 1 2 ) (16/3042) Hector8275 2009-12-05 2013-01-23 13:55:10 by 与狼共舞701
[MS] [已完结]MS5.5 计算问题 (4/866) hellrose 2012-04-11 2013-01-23 13:31:32 by xylz6188
[MS] [已完结]怎样从掺杂后体系的能带图确认其能隙变化? (0/1218) lzn_t 2013-01-23 2013-01-23 10:44:14 by lzn_t
[MS] 求合作sci,金属富勒烯的模拟 (9/1573) libo4sci 2012-10-25 2013-01-23 05:38:26 by libo4sci
[MS] [已完结]关于硅能带图和态密度分析    ( 1 2 ) (11/5405) yaoo_1 2011-11-20 2013-01-22 17:50:44 by liuupc919
[MS] [已完结]怎样确定计算晶格的带隙大小? (0/633) lzn_t 2013-01-22 2013-01-22 17:13:09 by lzn_t
[MS] [已完结]高聚物的退火问题 (0/650) yida 2013-01-22 2013-01-22 10:08:35 by yida
[MS] [已完结]在win7上安装ms6.0的球棍模型,球为什么是透明的? (3/973) wushujie 2013-01-21 2013-01-22 08:57:46 by hybren
[MS] [已完结]用Dmol优化石墨烯过程,出现一个问题,谁知道是怎么回事 (1/367) yushengbest 2013-01-16 2013-01-21 13:59:01 by hanfengpx
[MS] [已完结]弹性性质分析 (5/502) x163_yu 2013-01-20 2013-01-21 12:45:00 by souledge
[MS] 建摸时原子加不上去 (6/942) ping888 2013-01-19 2013-01-21 09:42:03 by ping888
[MS] [已完结]系综概念求助 (0/173) hanfengpx 2013-01-20 2013-01-20 21:08:11 by hanfengpx
[MS] [已完结]Dmol算热力学性质怎么设置温度? (3/583) aaq2800 2013-01-19 2013-01-20 15:37:15 by aaq2800
[MS] [已完结]dmol 问题 (1/429) qujinfeng 2012-04-06 2013-01-20 14:28:36 by zhuhy1116
[MS] [已完结]求助:Co3d6在MS中怎么设置自旋 (4/546) ping888 2013-01-18 2013-01-20 10:43:58 by ping888
[MS] [已完结]求助:关于CASTEP计算文章的审稿意见,谢谢!    ( 1 2 ) (15/1891) hecking 2013-01-14 2013-01-19 13:56:01 by Lathander
[MS] [已完结]XP下安装MS5.5的license出现问题,请大家帮忙 (5/1083) lhtlx95 2013-01-18 2013-01-19 12:16:23 by muzi1984
[MS] [已完结]关于castep的STM计算 (4/1776) lushunqi 2012-03-28 2013-01-19 08:10:23 by mirror27
[MS] 【求助】ms能带图 (11/2137) 442175020 2011-03-02 2013-01-18 18:01:21 by lzn_t
[MS] [已完结]结构优化后计算properties的时候总是失败,需要怎么改变参数设置? (0/1293) ycs3208 2013-01-18 2013-01-18 12:44:34 by ycs3208
[MS] [已完结]我计算的SrSi2N2O2:Eu的能带结构无带隙,求众大神分析(图) (0/279) stynazi 2013-01-18 2013-01-18 11:01:09 by stynazi
[MS] [已完结]MS 安装问题 (1/253) t13340033021 2013-01-17 2013-01-18 10:41:30 by weiyonkai
[MS] [已完结]怎样给指定的原子编号呢? (0/1001) hustren008 2013-01-18 2013-01-18 09:22:24 by hustren008
[MS] [已完结]CASTEP计算磷酸铁锂的一些参数设置问题 (2/1064) 建军 2012-07-04 2013-01-18 06:41:24 by ping888
[MS] [已完结]MS计算中的Energy Gap问题?    ( 1 2 ) (11/3207) lzn_t 2012-03-28 2013-01-18 05:22:32 by lzn_t
[MS] [已完结]MS计算中的Energy Gap问题? (3/561) lzn_t 2012-09-26 2013-01-18 05:07:47 by lzn_t
[MS] [已完结]请教 光电流是用什么仪器测的? (4/1344) leachmond 2012-12-04 2013-01-17 21:04:04 by yangking91
[MS] [已完结]ZnO价带顶能量 (0/447) qlpsw12 2013-01-17 2013-01-17 14:12:36 by qlpsw12
[MS] [已完结]关于几何优化前的参数设定问题》。 (0/697) npuouwen 2013-01-17 2013-01-17 13:11:29 by npuouwen
[MS] [已完结]关于finite displacement声子谱计算的问题 (8/1670) youqin5912 2012-12-29 2013-01-17 04:21:57 by xiaoaosky
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