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[热点] 土木工程281求调剂 乔兮木 2024-04-17 刚刚
[Abinit] [已完结]谁有已编译好的ABINIT，给我传下 (4/508) lufly89 2011-10-18 2011-10-18 15:19:46 by lufly89
[Abinit] 求助abinit中的晶体构建 5 (3/1012) pariah 2011-10-17 2011-10-18 14:27:29 by pariah
[Abinit] [已完结]如何用pathscale + openmpi 编译Abinit？ (7/925) vv_china 2011-08-30 2011-10-10 01:13:32 by vv_china
[Abinit] 使用WinSCP,为什么上传文件时会出现如下的错误？ 2 (0/6461) 20081130071 2011-10-08 2011-10-08 09:51:14 by 20081130071
[Abinit] 【求助】GW计算错误 (6/900) meimeinn 2010-04-28 2011-09-27 16:00:28 by 魏孟钟灵
[Abinit] 最新版ABINIT 6.6.3 出来啦，支持Windows 7 64位 (8/1594) lindlar0078 2011-06-16 2011-09-26 20:05:32 by nwpu2010
[Abinit] 计算时原子在晶胞的位置如何得到？ 10 (1/452) pariah 2011-09-23 2011-09-23 15:18:27 by pariah
[Abinit] 【求助】abinit除了能用GW对G点进行能带修正以外还能不能对其他高对称点的帶隙进行修� (8/1119) zxling 2010-05-06 2011-09-21 16:17:02 by 魏孟钟灵
[Abinit] abinit结构优化的结果怎么转化成cif文件？ 4 (3/749) mazuju028 2011-09-16 2011-09-20 09:24:25 by wenjlu
[Abinit] partial charge 5 (1/350) utdwang 2011-09-17 2011-09-17 09:43:22 by iamikaruk
[Abinit] [已完结]ABINIT服务器配置 (7/723) lufly89 2011-08-11 2011-09-15 10:31:44 by 贺仪
[Abinit] 关于ABINIT中DFPT计算的尺度问题 5 (0/317) xijinyang 2011-09-09 2011-09-09 14:31:07 by xijinyang
[Abinit] 分享一篇文章 MIT G. Ceder Thermodynamics of LixTiO2 from first principles (3/477) wienelxy001 2011-08-14 2011-08-21 18:07:56 by glcaihong
[Abinit] Abinit的GPU加速 (评阅+2) (5/847) zjuer 2011-07-01 2011-08-20 14:38:34 by vv_china
[Abinit] 计算N2键长问题 5 (0/731) gechaoyi 2011-08-15 2011-08-15 16:40:41 by gechaoyi
[Abinit] 静态static与t=0，p=0 (0/168) yy08 2011-08-09 2011-08-09 15:24:48 by yy08
[Abinit] abinit6.2.3的安装运行 (6/967) jiaxh 2011-07-21 2011-07-21 19:40:23 by jiaxh
[Abinit] 用ABINIT计算弹性常数出现以下问题？ 4 (3/558) yy08 2011-07-20 2011-07-20 19:43:33 by yy08
[Abinit] 光学计算参数tons设置的问题？ 20 (0/361) jinbiandou 2011-07-19 2011-07-19 12:08:01 by jinbiandou
[Abinit] Abinit 新旧版计算结果差别多大可以认为正常，没有安装错误之类的问题。 (4/1226) lei0819 2011-07-05 2011-07-18 07:53:47 by lei0819
[Abinit] [已完结]100金币求助abinit计算PDOS时ratsph参数设置所需的编辑文件 (3/622) jinbiandou 2011-06-22 2011-07-16 20:37:24 by lzl8181
[Abinit] [已完结]【求助成功】abinit-6.6.3（83M版）如何进行并行计算？？ (4/770) jinbiandou 2011-07-15 2011-07-16 08:33:28 by quantumfang
[Abinit] abinit 的安装 (6/1288) jiaxh 2011-07-12 2011-07-14 17:29:34 by sarchiel
[Abinit] [已完结]kptopt, ngkpt, nshiftk shiftk kptrlatt 这几个参数怎么设置 (2/854) gechaoyi 2011-07-11 2011-07-12 22:13:32 by zjuer
[Abinit] abinit 可以调用 ETSF 交换关联 函数，但 又要求赝势和 ixc 匹配，怎么办？ (5/724) mrd-81 2011-07-06 2011-07-11 09:07:10 by mrd-81
[Abinit] [求助]linux 版本Abinit 安装问题 (2/756) lei0819 2011-05-17 2011-07-05 20:46:26 by souledge
[Abinit] [已完结]如何从ABINIT网站上赝势提取赝势信息？ (评阅+1) (5/856) whyyzf5725 2011-06-28 2011-07-01 13:12:06 by iamikaruk
[Abinit] 有没有人用abinit算晶胞红外吸收光谱的？    ( 1 2 ) 10 (11/880) shuo2008 2011-06-12 2011-06-19 21:47:32 by shuo2008
[Abinit] 关于能带画图问题。 4 (8/1245) ridge8888 2011-06-16 2011-06-19 17:56:54 by 小草阳
[Abinit] [已完结]高压下优化 (3/424) ridge8888 2011-06-13 2011-06-15 19:05:57 by ridge8888
[Abinit] [已完结][关贴]求助台湾中正大学abinit教程里面的源代码 (1/402) ridge8888 2011-06-01 2011-06-13 12:36:38 by ridge8888
[Abinit] GW 方法可以算出能量， 用GW可以优化结构吗 (1/456) provels 2011-06-10 2011-06-12 20:32:05 by lvjian8596
[Abinit] abinit运行结果! 2 (1/1088) shuo2008 2011-06-12 2011-06-12 20:20:59 by zjuer
[Abinit] [已完结]与abinit有关的软件 (1/391) ridge8888 2011-06-12 2011-06-12 16:00:13 by iamikaruk
[Abinit] [已完结]虚心请教abinit几个问题。 (1/401) ridge8888 2011-06-12 2011-06-12 08:46:12 by wenjlu
[Abinit] [已完结]Abinit安装求助！ (2/451) shuo2008 2011-06-10 2011-06-11 11:58:17 by mazuju028
[Abinit] 压电性　MS　Abinit 4 (2/869) Andyzd 2011-06-10 2011-06-11 00:47:13 by 白衣
[Abinit] 【分享】abinit实例 (4/1219) fanny0007 2010-12-01 2011-06-10 07:23:15 by yjwyjwyjw
[Abinit] [已完结]abinit的外围程序 (2/499) ridge8888 2011-06-09 2011-06-09 10:56:31 by wenjlu
[Abinit] 【求助】求助安装abinitbandstructuremaker.py? (3/586) frank_zhan 2010-10-29 2011-06-08 20:04:25 by kcg001kcg
[Abinit] 【求助】AbinitBandStructureMaker谁用过啊？ (3/677) guoxiaoqiao 2010-11-24 2011-06-08 20:01:11 by kcg001kcg
[Abinit] 【求助】关于Born effective charge的问题 2 (3/1264) yy08 2010-10-31 2011-06-06 00:47:40 by iamikaruk
[Abinit] abinit计算分波态密度时ratsph参数该如何设置 10 (2/429) mazuju028 2011-05-09 2011-06-05 21:51:20 by jinbiandou
[Abinit] 改进嵌入原子法-Modified Embedded Atom Method (3/773) haode22 2011-05-29 2011-05-30 14:43:36 by jsheng5059
[Abinit] [已完结]A segmentation fault when doing LiBH4 Raman spectra calculation    ( 1 2 ) (15/1467) qiqi2926 2011-05-23 2011-05-27 13:45:33 by 贺仪
[Abinit] ABINIT 官网上提供的Windows版本和Linux版本 (0/597) lei0819 2011-05-17 2011-05-17 10:38:12 by lei0819
[Abinit] [已完结]abinit.6.6.3 不能并行，各位请 帮我看看如何设置，谢谢！ (3/629) jinbiandou 2011-05-16 2011-05-16 19:42:54 by jinbiandou
[Abinit] 计算Raman spectra时，分析anaddb输出文件时，出现问题 1 (0/251) qiqi2926 2011-05-16 2011-05-16 15:56:39 by qiqi2926
[Abinit] 有关BigDFT的问题！ 5 (6/913) haowenping 2011-05-02 2011-05-15 22:24:09 by haowenping
[Abinit] abinit 能计算团簇模型吗？？求指点一二 3 (1/292) fanny0007 2011-05-09 2011-05-09 10:00:50 by jinbiandou
[Abinit] abinit能否处理一个位置被两种元素占据的固溶体的能带和态密度 (1ST强帖+1)(10/2275) ljjhb1 2011-05-07 2011-05-08 10:35:53 by fzx2008
[Abinit] [已完结]abinit能否像castep一样直接计算出吸收光谱，谢谢， (1ST强帖+1)(5/702) ljjhb1 2011-04-19 2011-05-05 16:43:10 by awmc2008
[Abinit] [已完结][关贴]ZnO的ecut测试有问题，请帮忙指点一下，谢谢！ (0/523) jinbiandou 2011-05-04 2011-05-04 23:18:40 by jinbiandou
[Abinit] 【求助】abinit安装问题！急！ 4 (3/915) xijinyang 2010-08-25 2011-05-02 10:24:27 by haowenping
[Abinit] ABINIT结构优化中三个优化例子的不同之处是什么？ 10 (2/677) jinbiandou 2011-04-30 2011-04-30 23:16:05 by jinbiandou
[Abinit] 【求助】赝势中考虑到了相对论效应 是否计算中一定要考虑阿 (2/755) meyhf 2011-04-16 2011-04-28 11:55:24 by lihb734
[Abinit] [已完结][关贴]abinit计算能带结构、光学性质前是不是也要作结构优化？ (5/1163) jinbiandou 2011-04-27 2011-04-27 22:39:57 by bingmou
[Abinit] [已完结]abinit（windows版5.8.4）中X.in和in.files文件在什么程序中写的？ (2/421) jinbiandou 2011-04-24 2011-04-24 15:58:37 by lzl8181
[Abinit] 【求助】关于用ABINIT计算非线性光学的几个问题？ 44 (11/2158) yy08 2011-01-13 2011-04-22 16:05:28 by yy08
[Abinit] [已完结]看Castep中寻找对称性有什么意义？ (5/925) cshcgy 2011-04-21 2011-04-22 00:00:41 by phys
[Abinit] 【求助】Abinit可以算掺杂的能带吗？最多能算到多少个原子？ (5/1013) qiwei505 2010-04-27 2011-04-14 16:35:53 by fanny0007
[Abinit] 【求助成功】Si 的激子结合能 5 (2/2451) 子虚乌有5388 2010-05-29 2011-04-14 16:27:18 by fanny0007
[Abinit] 【求助】GW计算中k点的选择问题    ( 1 2 ) (16/1514) hometownlove 2010-05-20 2011-04-14 16:22:34 by fanny0007
[Abinit] 【求助】etotal计算结果异常 4 (1/353) kwit 2011-04-10 2011-04-10 22:39:45 by mazuju028
[Abinit] 【求助】请问abinit能否计算超导体费米面 10 (0/158) tanxingyi2 2011-04-09 2011-04-09 10:08:31 by tanxingyi2
[Abinit] 【分享】6.6.2出来了，同时带windows版 (评阅+1) (2/323) huangye2001 2011-04-07 2011-04-07 14:31:42 by fzx2008
[Abinit] 【求助】Abinit 网站上不去了 4 (1/241) haiw201 2011-04-06 2011-04-06 13:31:58 by zzy870720z
[Abinit] 【求助】安装abinit-6.2.3出现的新问题？请教 (5/1230) frank_zhan 2010-10-02 2011-04-03 18:54:56 by mazuju028
[Abinit] 【求助】刚开始涉足第一性原理的计算模拟，请各位同学给点指导和建议啊！！！ 8 (6/809) cugfish 2011-03-26 2011-03-29 08:11:10 by hanpeng972
[Abinit] 【求助】Abinit 计算固体的磁性和电输运性质以及晶体结构效果如何？ (0/267) lei0819 2011-03-24 2011-03-24 20:48:13 by lei0819
[Abinit] 【求助】这样的结构优化结果是否误差有点大了？ (4/693) mazuju028 2011-03-22 2011-03-23 08:41:49 by fzx2008
[Abinit] [关贴]【求助完毕】Abinit 6.2.3安装出错 (7/1309) 子虚乌有5388 2010-09-24 2011-03-22 10:48:55 by fanny0007
[Abinit] 【求助】abinit 计算raman spectra出现的问题，以前没遇到过，不知道错在哪里 (2/354) qiqi2926 2011-03-17 2011-03-21 14:48:47 by qiqi2926
[Abinit] 【求助】怎样让abinit跑起来？    ( 1 2 ) (11/1056) lzl8181 2010-08-31 2011-03-19 12:16:49 by 25351048
[Abinit] 【分享】ABINIT中有关自旋设定的资料 (5/848) identation 2010-04-08 2011-03-17 09:10:17 by zhenfeili
[Abinit] 【求助】abinit CaO2*2*2超晶包算能带 2 (0/163) fanny0007 2011-03-15 2011-03-15 14:34:41 by fanny0007
[Abinit] 【求助】关于对称群的问题？ (2/397) hbnuwangshuling 2011-03-06 2011-03-07 11:17:27 by hbnuwangshuling
[Abinit] 【求助】Ni的声子计算 (0/620) hhwj340 2011-02-28 2011-02-28 23:02:06 by hhwj340
[Abinit] 【求助】在服务器上编译Abinit出错？？？？？ (2/269) lindlar0078 2011-02-22 2011-02-24 12:15:38 by lindlar0078
[Abinit] 【求助】abinit能不能做NPT系宗的分子动力学计算？ (0/260) jsheng5059 2011-02-24 2011-02-24 11:59:19 by jsheng5059
[Abinit] 【求助】abinit和Siesta的请进啊，，，两软件各有什么特点 26 (13/1900) 75150618 2010-12-13 2011-02-22 17:57:32 by zhangguangping
[Abinit] 【求助】Abinit分轨道电子态密度中l=0,l=1,l=2,.....的意义 (4/804) yuwenxianglong 2011-02-16 2011-02-18 16:37:51 by fzx2008
[Abinit] 【其他】内存要求 (1/244) zjuer 2011-02-17 2011-02-17 13:34:16 by wenjlu
[Abinit] 【其他】不同操作系统下的abinit下载 (1/419) lzl8181 2011-01-27 2011-01-27 17:51:59 by awmc2008
[Abinit] 【原创】abinit 又出新版本了 (评阅+1) (2/304) mrd-81 2011-01-11 2011-01-13 15:33:09 by yy08
[Abinit] 【求助】请教 4x4x6 Monkhorst-Pack grid (3/930) woshiqiube 2011-01-04 2011-01-13 11:48:50 by yy08
[Abinit] 【求助】请问Occupation matrix for correlated orbitals该如何理解 (0/290) Local_Spin 2011-01-10 2011-01-10 20:06:54 by Local_Spin
[Abinit] 【求助】为什么Abinit6.4.1等高版本的软件包算东西比以前的5.8.x版本慢那么多？ (5/714) frank_zhan 2010-10-30 2011-01-09 19:36:27 by mazuju028
[Abinit] 【求助】怎么确定abinit计算能带结构的费米能位置 5 (6/1337) xijinyang 2010-12-08 2011-01-07 19:50:43 by frank_zhan
[Abinit] 【求助】红帽 expertise 5.5 安装abinit 6.4.2的问题 5 (6/931) oscar5667 2010-12-31 2011-01-07 09:41:31 by lhx00555
[Abinit] 【求助】能不能在结构优化结束后立刻计算能带结构？ (3/416) frank_zhan 2011-01-05 2011-01-06 12:19:41 by frank_zhan
[Abinit] 【求助】关于abinit的结构优化 (6/1149) xijinyang 2010-12-09 2011-01-05 20:34:47 by frank_zhan
[Abinit] 【求助】nband和occ 设置 10 (3/1698) xsw841020 2010-12-23 2010-12-24 09:22:48 by fzx2008
[Abinit] 【求助】有关anaddb中elphsmear和a2fsmear的取值 5 (3/520) xijinyang 2010-12-14 2010-12-20 17:56:23 by mrd-81
[Abinit] 【求助】为什么abinit-6.2.3 tutorial 里面的lesson3运行不了? (7/1043) frank_zhan 2010-10-04 2010-12-15 21:33:09 by frank_zhan
[Abinit] 【求助成功】abinit GW例子运行tgw1_3.in进行ecutwfn收敛性测试失败，求达人进来看看 5 (1/850) fanny0007 2010-12-14 2010-12-14 16:06:44 by fanny0007
[Abinit] 【求助】有关用abinit计算拉曼光谱 9 (1/423) hzy900211 2010-12-06 2010-12-13 09:49:55 by frank_zhan
[Abinit] 【求助成功】abinit 计算2X2X2supercell MgO 的DOS （16个原子） (8/1350) fanny0007 2010-12-07 2010-12-13 09:44:21 by frank_zhan
[Abinit] 【求助】Abinit 是免费的软件吗？？    ( 1 2 ) (13/2945) gfei2008 2009-09-16 2010-12-10 12:05:06 by qx08131989
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