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[热点] 多组分精馏求助 高树桩 2026-02-03 刚刚
[Vasp&Me ] 【求助】vasp运行出错 (1/717) VASP2010 2010-10-04 2010-10-04 18:15:13 by valenhou001
[Vasp&Me ] 【求助】贡献50金币,求vasp,在论坛上找到的,用纳米盘总是下不了    ( 1 2 ) (16/1100) Janboma 2010-09-26 2010-10-03 23:30:28 by Janboma
[Vasp&Me ] 【求助】vi修改文件后vasp运行后还是原来没修改的结果。为什么?    ( 1 2 ) (10/1468) VASP2010 2010-09-20 2010-10-03 22:45:29 by VASP2010
[Vasp&Me ] 【求助】直接从国外而不经过国内的代理商购买VASP的流程是怎样的? (1/1177) xiaowandouer 2010-09-30 2010-09-30 16:10:43 by bingmou
[Vasp&Me ] 【求助】求六角表面的高对称点坐标 (2/1061) 雪狼1210 2010-09-27 2010-09-30 13:51:12 by 雪狼1210
[Vasp&Me ] 【求助】结合能计算 (6/1820) xiaojie7783 2010-04-21 2010-09-29 22:44:41 by 4010808
[Vasp&Me ] 【求助】Fermi smearing function 是怎么设的? (5/1402) cuihang 2010-09-29 2010-09-29 21:48:48 by awmc2008
[Vasp&Me ] 【求助】令人头疼的relax,大家帮忙分析一下问题出在那里? (9/1512) vaspstudy 2010-09-27 2010-09-28 18:47:15 by hughluhan
[Vasp&Me ] 【求助成功】VASP POSCAR 关于模拟盒子大小 求助一下 (评阅+2) (2/900) qphll 2010-09-28 2010-09-28 14:12:58 by fanchen021
[Vasp&Me ] 【其他】多核单机运行vasp,并行/串行那个效果更好 (2/1408) vaspstudy 2010-09-27 2010-09-28 10:47:33 by dxcharlary
[Vasp&Me ] 【求助】这样写POSCAR的晶格矢量对吗? (评阅+1) (3/1655) wang-lf09 2010-09-27 2010-09-28 09:02:47 by hn19870519
[Vasp&Me ] 【求助】带电团簇在vasp中ICHARGE的设置 (1/2157) Ilovenewyork 2010-09-27 2010-09-28 08:30:51 by cenwanglai
[Vasp&Me ] 【求助】优化孤立分子遇到问题,求助 (4/901) wvsw 2010-08-30 2010-09-28 08:13:44 by cenwanglai
[Vasp&Me ] 【求助】POSCAR中第二行具体怎么取,代表什么意思呀? (2/1105) wang-lf09 2010-09-27 2010-09-27 22:48:13 by hughluhan
[Vasp&Me ] 【求助】一维情况的k点设置 (6/1188) 小木虫于 2010-09-25 2010-09-27 17:23:05 by sunyang1988
[Vasp&Me ] 【求助】单机四核并行效率怎么这么低?    ( 1 2 ) (11/2131) wang-lf09 2010-09-26 2010-09-27 07:50:36 by keda
[Vasp&Me ] 【求助】现在的多核电脑与cluster有什么区别? (8/877) vaspstudy 2010-09-23 2010-09-26 14:38:07 by wuli8
[Vasp&Me ] 【求助】如何给体系加应变 (3/1191) 子虚乌有5388 2010-09-23 2010-09-25 17:46:36 by sunyang1988
[Vasp&Me ] 【求助】关于自旋极化的问题 (4/1330) fulin 2010-09-15 2010-09-25 12:46:29 by jphuang_63
[Vasp&Me ] 【求助】盼高手指点,NEB计算 (1/824) wqg1806 2010-09-24 2010-09-24 18:02:21 by fanchen021
[Vasp&Me ] 【求助】请教spin-polarized caculation (8/1560) lgxyz 2010-09-19 2010-09-24 10:26:36 by lgxyz
[Vasp&Me ] 【求助】vasp做NEB是不是必须并行安装才可以? (3/585) vaspstudy 2010-09-23 2010-09-23 21:35:01 by fanchen021
[Vasp&Me ] 【求助】如何分析出掺杂后的结构对称性 (3/905) calos818 2010-09-23 2010-09-23 20:02:32 by bingmou
[Vasp&Me ] 【求助】Vasp计算DOSCAR输出 (2/700) wqg1806 2010-09-18 2010-09-23 19:33:54 by bingmou
[Vasp&Me ] 【求助】如何用VASP计算电极化强度 (2/886) wbt11129 2010-07-08 2010-09-23 15:30:35 by wbt11129
[Vasp&Me ] 【求助】如何画出空位点缺陷的的DOS和PDOS (2/582) vaspstudy 2010-09-22 2010-09-22 23:06:53 by bingmou
[Vasp&Me ] 【求助】原子振动频率的计算 (1/1221) sunyang1988 2010-09-20 2010-09-22 01:09:34 by gfei2008
[Vasp&Me ] 【求助】第一原理怎么计算屈服极限 (8/2510) zhanganping 2010-09-21 2010-09-21 16:08:04 by zxzj05
[Vasp&Me ] 【求助】关于磁性的计算 (2/471) lgxyz 2010-09-21 2010-09-21 15:13:39 by lgxyz
[Vasp&Me ] 【求助】表面吸附计算 (9/1302) cqgzc 2010-07-13 2010-09-21 08:18:47 by guolianshun
[Vasp&Me ] 【求助】体系中加一个电子问题 (2/406) weiwei128 2010-09-20 2010-09-20 22:10:15 by sunyang1988
[Vasp&Me ] 【求助】关于ISPIN和LORBIT (1/612) lgxyz 2010-09-20 2010-09-20 22:06:39 by sunyang1988
[Vasp&Me ] 【求助】关于过渡金属氧化物的能带宽度与磁性 (3/1490) gzqdyouxia 2010-07-29 2010-09-20 16:42:40 by guolianshun
[Vasp&Me ] 【求助】vasp优化单独的气体分子,K点必须取1 1 1吗? (2/1044) wanghui381 2010-09-20 2010-09-20 09:22:59 by lgxyz
[Vasp&Me ] 【求助】vasp不同磁结构最后的收敛问题 (6/1397) calos818 2010-09-16 2010-09-20 07:40:38 by calos818
[Vasp&Me ] 【求助】关于vasp (2/446) chiqiong 2010-09-19 2010-09-19 17:06:42 by lgxyz
[Vasp&Me ] 【求助】求linux下的p4vasp (4/1397) zhjh888888 2010-03-31 2010-09-19 14:55:08 by cenwanglai
[Vasp&Me ] 【求助】关于EDIFFG 用能量还是用力? (9/1473) lgxyz 2010-09-17 2010-09-18 09:01:04 by lgxyz
[Vasp&Me ] 【求助】出现以下警告一般是哪些设置出现了问题? (4/908) 215215 2010-09-17 2010-09-17 16:11:13 by sunyang1988
[Vasp&Me ] 【求助】VASP计算cluster出错! (5/1181) zmj110 2010-09-17 2010-09-17 14:50:22 by zmj110
[Vasp&Me ] 【求助】报错LAPACK: Routine ZPOTRF failed (1/1207) liluyan 2010-09-16 2010-09-16 19:56:04 by peng.029
[Vasp&Me ] 【求助】有人用vasp算过LDA+U吗 (2/302) Akuang 2010-09-16 2010-09-16 17:17:04 by Akuang
[Vasp&Me ] 【求助】vasp做表面结构 (2/263) chiqiong 2010-09-16 2010-09-16 17:09:46 by chiqiong
[Vasp&Me ] 【求助】VASP计算cluster出错! (2/920) zmj110 2010-09-16 2010-09-16 15:11:28 by zmj110
[Vasp&Me ] 【求助】给一种结构两种不同的磁矩分布,结果得到相同的磁矩分布,但能量却相差很大 (3/974) 小木虫于 2010-09-15 2010-09-16 09:26:23 by valenhou001
[Vasp&Me ] 【求助】优化ENCUT出现异常    ( 1 2 ) (19/1334) lgxyz 2010-06-26 2010-09-16 08:33:37 by lgxyz
[Vasp&Me ] 【求助】VASP结构优化 (7/2138) chen_yang 2010-08-03 2010-09-16 01:47:32 by 1003307944
[Vasp&Me ] 【求助】VASP的开发组名称叫什么? (1/448) vaspstudy 2010-09-15 2010-09-15 23:58:14 by hchfox
[Vasp&Me ] 【求助】关于vasp占用的内存 (1/825) lgxyz 2010-09-15 2010-09-15 19:23:57 by lgxyz
[Vasp&Me ] 【求助】关于vasp NEB (评阅+1) (8/2179) lgxyz 2010-09-07 2010-09-15 17:47:08 by peng.029
[Vasp&Me ] 【求助】帮忙VASP写个小程序    ( 1 2 3 ) (21/2216) wo8165827 2010-09-11 2010-09-15 11:03:33 by 拓海1627
[Vasp&Me ] 【求助】推荐些好用的EOS状态方程拟合程序 (3/1262) calos818 2010-09-14 2010-09-15 08:10:54 by calos818
[Vasp&Me ] 【求助】求后钙钛矿的POSCAR文件坐标 (4/926) cuihang 2010-09-14 2010-09-14 22:17:48 by cuihang
[Vasp&Me ] 【求助成功】谁能发给我一个Gaussian Veiw,谢谢! (2/209) sunyang1988 2010-09-14 2010-09-14 16:44:59 by whong
[Vasp&Me ] 【求助】表面结构 (1/243) chiqiong 2010-09-14 2010-09-14 15:59:19 by valenhou001
[Vasp&Me ] 【求助】请问如何限制磁矩方向和大小 (6/1831) 020080730 2010-09-10 2010-09-14 14:44:41 by valenhou001
[Vasp&Me ] 【求助】vasp的HSE泛函 (2/1335) ikea1984 2010-09-02 2010-09-14 00:00:40 by hughluhan
[Vasp&Me ] 【求助】vasp的精度 (6/618) yidiandian2703 2010-09-13 2010-09-13 23:56:22 by yidiandian2703
[Vasp&Me ] 【求助】vasp计算的结果显示segmentation fault是什么错误 (5/1734) chiqiong 2010-09-12 2010-09-13 10:19:26 by chiqiong
[Vasp&Me ] 【求助】问个关于vasp能量的老问题 (3/836) chimegreen 2010-09-12 2010-09-13 08:56:07 by cenwanglai
[Vasp&Me ] 【求助】vasp计算能带K点选取 (2/1522) bnliu 2010-09-08 2010-09-13 08:33:40 by bnliu
[Vasp&Me ] 【求助】请问stdout (2/249) lgxyz 2010-09-12 2010-09-12 19:38:35 by lgxyz
[Vasp&Me ] 【求助】提交任务后,这是nohup.out文件,各位高手帮忙看看有没有问题 (3/1131) chiqiong 2010-09-12 2010-09-12 12:13:17 by cenwanglai
[Vasp&Me ] 【求助】正则系综分子动力学模拟一个设置问题 (2/884) stractor 2010-09-11 2010-09-12 09:08:27 by fantouwen
[Vasp&Me ] 【求助】vasp做分子动力学模拟 (5/1500) gzhao1980 2010-09-04 2010-09-11 10:46:53 by gavinliu7390
[Vasp&Me ] 【求助】CO算例求助 (1/418) 江山2010 2010-08-12 2010-09-11 10:04:11 by guolianshun
[Vasp&Me ] 【求助】ZnO中的缺陷荷电状态怎么定    ( 1 2 ) (11/1688) vaspstudy 2010-09-09 2010-09-11 09:22:20 by vaspstudy
[Vasp&Me ] 【求助】vasp安装问题,急求解决办法~~~ (7/1232) 眉峰 2010-09-08 2010-09-11 09:11:35 by 贺仪
[Vasp&Me ] 【求助】计算 再次出错?? 呵呵 (1/220) zhuguomin1 2010-09-03 2010-09-11 08:37:02 by zhuguomin1
[Vasp&Me ] 【求助】关于vasp (1/454) chiqiong 2010-09-10 2010-09-11 00:57:06 by vimtex
[Vasp&Me ] 【求助】vasp 金属体相优化 (0/576) lgxyz 2010-09-10 2010-09-10 19:05:01 by lgxyz
[Vasp&Me ] 【求助】怎样把linux的bash脚本编译成windows下的可执行文件(.exe)    ( 1 2 ) (16/1744) sunyang1988 2010-09-10 2010-09-10 18:37:05 by hedaors
[Vasp&Me ] 【求助】vasp计算出错 (评阅+1) (2/725) piaoxue001 2010-08-31 2010-09-10 16:18:44 by piaoxue001
[Vasp&Me ] 【求助】关于晶体表面 (4/685) lgxyz 2010-09-09 2010-09-10 16:15:25 by gaottgougou
[Vasp&Me ] 【求助】关于vasp (3/407) chiqiong 2010-09-09 2010-09-10 16:10:10 by ifmc1234
[Vasp&Me ] 【求助】关于表面覆盖率 (3/594) lgxyz 2010-09-09 2010-09-10 08:54:35 by fanchen021
[Vasp&Me ] 【求助】poscar文件中的笛卡尔坐标一直迷惑,求解    ( 1 2 ) (评阅+1) (11/2441) 信任开花 2010-09-07 2010-09-08 20:13:27 by meinvren
[Vasp&Me ] 【求助】表面能计算时slab和bulk的区别 (2/2329) FFFd3689 2010-09-08 2010-09-08 14:50:29 by valenhou001
[Vasp&Me ] 【求助】VASP正则系综模拟问题 (4/1514) stractor 2010-09-02 2010-09-08 08:21:48 by stractor
[Vasp&Me ] 【求助】如何从DOS看High Spin 和Low Spin态 (评阅+1) (7/1438) calos818 2010-09-07 2010-09-07 21:25:38 by 江山8806
[Vasp&Me ] 【求助】vasp 对于一维问题 能带和态密度能否同时算得 (评阅+1) (0/306) 小木虫于 2010-09-07 2010-09-07 12:27:46 by 小木虫于
[Vasp&Me ] 【求助】lev00 (2/603) yueya9113 2010-09-05 2010-09-07 08:43:42 by cenwanglai
[Vasp&Me ] 【求助】如何用VASP计算计入应变的缺陷形成能 (2/471) bnliu 2010-09-01 2010-09-07 01:14:17 by icyspace
[Vasp&Me ] 【求助】vasp计算出现的问题 (0/426) 真实的自我 2010-09-05 2010-09-06 21:27:44 by 真实的自我
[Vasp&Me ] 【求助】碳纳米管 硅橡胶 分散度 软件 (0/472) gzhao1980 2010-09-06 2010-09-06 21:27:26 by gzhao1980
[Vasp&Me ] 【求助】vasp计算光学性质 (2/849) 子虚乌有5388 2010-09-06 2010-09-06 19:19:39 by 子虚乌有5388
[Vasp&Me ] 【求助】关于+U方法的总能上的疑问    ( 1 2 ) (10/1551) hadone 2009-09-29 2010-09-06 16:45:32 by zhang668
[Vasp&Me ] 【求助】计算能带及态密度 (2/697) 小木虫于 2010-09-05 2010-09-05 18:44:34 by sunyang1988
[Vasp&Me ] 【求助】ISMEAR=0时,能量取哪个? (1/1285) zhang668 2010-09-04 2010-09-05 15:53:23 by cenwanglai
[Vasp&Me ] 【求助】态密度中6d贡献部分丢失 (3/607) txf8378 2010-09-03 2010-09-05 11:11:22 by fzx2008
[Vasp&Me ] 【求助】vasp出错,potcar (1/715) zhaohuxian 2010-09-03 2010-09-05 08:39:04 by gfei2008
[Vasp&Me ] 【求助】vasp的电子自洽和原子核优化过程是否可以分开? (4/1061) yidiandian2703 2010-09-03 2010-09-04 10:21:16 by yidiandian2703
[Vasp&Me ] 【求助】真空层厚度的如何设置 (金币≥10)(7/89) 真实的自我 2010-09-02 2010-09-03 19:43:30 by ice_rain
[Vasp&Me ] 【求助】单机多核用vasp NEB做过渡态 可行吗? (5/905) lgxyz 2010-09-02 2010-09-03 10:06:19 by hgye
[Vasp&Me ] 【其他】VASP5.2的杂化泛函计算速度如何? (3/1619) jglee646 2010-09-02 2010-09-02 11:23:47 by stractor
[Vasp&Me ] 【求助】VCA和SCPA的区别 (1/2788) marsdoing 2010-01-06 2010-09-02 11:21:53 by 25351048
[Vasp&Me ] 【求助】如何画分波态密度和能带图 急 (金币≥20)(9/237) zengchangan 2010-08-21 2010-09-02 11:10:02 by aray1577
[Vasp&Me ] 【求助】p4vasp作图的能量零点是如何定义的 (9/1430) vaspstudy 2010-08-27 2010-09-02 07:33:43 by ylli
[Vasp&Me ] 【求助】关于vasp能量 (5/1089) lgxyz 2010-08-30 2010-09-01 19:56:48 by dxcharlary
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