24小时热门版块排行榜    

管理团队 (金币库 106926 充值 )

主管区长:
月只蓝小红豆
主管版主:
zhou2009paramecium86

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] 2025 - Greene's Protective Groups in Organic Synthesis - 6th Edition asymmsyn 2026-01-12 刚刚
[Gaussian] [已完结]高斯过渡态 (3/866) ljh06 2020-05-09 2020-05-10 11:35:17 by ljh06
[Gaussian] [已完结]求gaussian09中文说明书 (0/684) ljh06 2020-05-09 2020-05-09 17:40:57 by ljh06
[Gaussian] [已完结]高斯不同限定方式有区别吗 (1/464) 悠哉2020 2020-05-09 2020-05-09 10:57:38 by paramecium86
[其他] [已完结]ORCA和RI加速是什么意思 (2/3911) 独孤立啊 2017-11-11 2020-05-08 11:15:59 by 浴雪飘零_
[其他] 习题答案 (6/767) 我是小毛驴3 2020-02-25 2020-05-07 21:27:34 by awmc2008
[Gaussian] [已完结]过渡态出现两个虚频求助 (2/1939) maxuexiang 2020-05-06 2020-05-07 11:43:53 by maxuexiang
[HyperCh ] [已完结][关贴]求hyperchem安装包一份 (1/847) yc4789 2020-05-06 2020-05-06 22:03:42 by paramecium86
[Gaussian] [已完结]求Gaussian16 ,gaussview windows版本安装包 (3/3643) xinlixi 2020-04-29 2020-05-06 14:51:55 by xinlixi
[Gaussian] [已完结]求助TMPO作为探针吸附,通过理论计算得到的31P核磁数据应以什么为基准 (0/341) 夏茉爽爽 2020-05-06 2020-05-06 12:21:32 by 夏茉爽爽
[Gaussian] 如何利用Gaussian 09计算含能材料的爆炸焓 (2/532) 孤狼1 2020-05-03 2020-05-05 19:47:33 by 孤狼1
[其他] [已完结]web of science的文献到不到endnote中    ( 1 2 ) (12/3247) 836449366 2013-06-17 2020-05-05 19:00:26 by Elahhh
[Gaussian] [已完结][关贴]求gaussian09或16 X64的 linux安装包~ (2/890) wwja 2020-05-03 2020-05-03 17:27:32 by wwja
[Gaussian] [已完结][关贴]求Gaussian09/16 ,gaussview windows版本安装包 (3/1007) xujinhuibest 2020-05-02 2020-05-02 17:48:15 by 680416
[Gaussian] [已完结]ONIOM方法请教 (0/342) duxiaozixin 2020-05-01 2020-05-01 10:10:42 by duxiaozixin
[Gaussian] [已完结]gaussian过渡态关键词区别 (6/1598) 悠哉2020 2020-04-29 2020-04-30 12:52:27 by 悠哉2020
[Molpro/ ] molcas说明书 (24/2220) yw_fish 2013-12-11 2020-04-29 05:59:11 by mjjdlut
[量化新手 ] 《资源整合篇》重磅推出,史上最全资料!!!(不断更新中。。。。。)    ( 1 2 3 4 5 6 ) (299/14834) gkf高 2011-11-01 2020-04-29 05:38:20 by mjjdlut
[量化新手 ] 《资源整合篇3》重磅推出,史上最全资料!!!(不断更新中。。。。。)    ( 1 2 3 4 ) (195/6849) gkf高 2011-11-03 2020-04-28 18:30:12 by mjjdlut
[Gaussian] [已完结][关贴]跪求一份win10 64位的Gaussian和GaussView (3/1241) blackstar117 2020-04-26 2020-04-27 13:09:20 by blackstar117
[Linux应 ] [关贴]求gaussian E01 lunix版 (2/821) JosephWen 2020-04-26 2020-04-26 21:56:14 by paramecium86
[Gamess/ ] [已完结]救助wxmacmolplt7.7 win7 64位 (2/1767) haiqin28 2016-10-15 2020-04-26 19:58:07 by SHJSHJ
[Gaussian] [已完结]求助理论计算方面有关31P核磁的文献 (0/314) 夏茉爽爽 2020-04-26 2020-04-26 10:05:47 by 夏茉爽爽
[Gaussian] [已完结]询问光电谱中electron kinetic energy与electron binding energy之间的关系 (2/3864) cug_zhang 2016-01-19 2020-04-25 19:34:39 by wonderfulong
[Gaussian] 请问在高斯输入文件中,85%的H3PO4溶液怎么表示? (5/509) 夏茉爽爽 2020-04-25 2020-04-25 18:29:06 by xspring0808
[其他] [已完结]什么是自旋轨道耦合作用 (5/2970) 444608202 2012-11-02 2020-04-25 14:59:18 by dreek
[已完结]求助,跑opt+freq时未报错但是任务停止,该如何处理 (7/1106) zhizi24235 2020-04-25 2020-04-25 14:08:18 by zhizi24235
[Gaussian] [已完结][关贴]求Gaussian09和Gaussionview的linux64版本 (2/704) cosfrist 2020-04-25 2020-04-25 10:42:04 by paramecium86
[Multiwfn] Multiwfn的一些问题 (2/1034) 东方的朝日 2020-04-24 2020-04-25 07:22:14 by 东方的朝日
[Gaussian] 高斯中收敛是什么意思? (1/1256) 悠哉2020 2020-04-24 2020-04-24 20:54:54 by paramecium86
[Gaussian] [已完结]求问出现Error termination in NtrErr: NtrErr called from FIOCnC该如何解决 (2/642) zhizi24235 2020-04-24 2020-04-24 13:57:55 by zhizi24235
[其他] [已完结]想问问HOMO-4是什么意思和怎么读? (3/691) 有机的? 2020-04-23 2020-04-24 10:35:23 by paramecium86
[Gaussian] [已完结]理论计算31P核磁数据处理方法 (1/462) 夏茉爽爽 2020-04-24 2020-04-24 10:16:20 by paramecium86
[Gaussian] [已完结][求助]急求用高斯算完后怎么看HOMO和LUMO的数值?    ( 1 2 ) (10/4425) 梓柳黎swift 2017-07-23 2020-04-24 06:22:18 by 晴天_xmc
[Gaussian] [已完结]求助linux版 guass09软件。 (2/490) 小强精神 2019-11-19 2020-04-23 14:13:06 by 小强精神
[Gaussian] [已完结][关贴]求助Gaussian 09的64位linux版本 (4/1103) amin0241 2019-11-14 2020-04-22 13:59:40 by 孤狼1
[Gaussian] [已完结][关贴]求Gaussian软件 (8/1797) 散岁的微光 2019-11-19 2020-04-22 13:58:13 by 孤狼1
[Gaussian] 过渡态出现两个虚频怎么解决? (2/1243) 节能灯希望 2020-04-07 2020-04-22 07:36:08 by liweiyi123456
[Gaussian] 高斯软件计算的分子轨道能级差和紫外吸收光谱中ΔE (25/2146) teng251344 2020-04-19 2020-04-21 21:19:33 by 誓小言
[其他] [已完结]请问关于AICD 磁感应电流方向的问题 (0/714) luqing6879 2020-04-21 2020-04-21 10:39:34 by luqing6879
[Gaussian] 【共享】计算化学反应过渡态博士论文    ( 1 2 3 4 5 6 ) (253/15075) majun04 2008-12-08 2020-04-21 05:39:24 by niu19950701
[量化新手 ] [已完结]各位大佬帮帮忙,看看我的问题 (2/688) carbene312 2020-04-19 2020-04-20 23:46:48 by paramecium86
[Gaussian] [已完结][关贴]高斯NBO的log文件 (1/659) 悠哉2020 2020-04-20 2020-04-20 23:43:43 by paramecium86
[量化图形 ] [已完结]gabedit 手册 (1/2300) 海天酱油2号 2015-01-07 2020-04-19 19:45:28 by 学习代表
[Gaussian] [已完结]高斯溶剂化全优化 (4/2439) ljh06 2020-04-18 2020-04-19 14:05:03 by ljh06
[Gaussian] [已完结]Gaussian计算红外峰如何归属 (4/1185) wangjielin 2015-12-24 2020-04-18 13:31:12 by paramecium86
[Gaussian] [已完结]求Gaussian 9.0 linux版本安装包,谢谢! (4/1306) y851012172 2020-03-09 2020-04-17 15:18:04 by 303103263
[Gaussian] 高斯软件的使用    ( 1 2 ) (50/5297) 813942660 2017-02-27 2020-04-16 14:10:01 by sxhuo
[Gaussian] [已完结][关贴]倾尽所有,求助一简单的量化计算,计算过渡态能量 (2/506) 质谱分析 2020-04-15 2020-04-15 17:53:40 by www1
[Gaussian] [已完结]高斯输出文件怎么看 (1/740) 悠哉2020 2020-04-15 2020-04-15 12:00:00 by paramecium86
[Gaussian] [已完结][关贴]求Gaussian09和Gaussionview的windows版本 (2/677) sxhuo 2020-04-14 2020-04-15 11:58:49 by sxhuo
[量化图形 ] [已完结]求Gaussionview最新版 windows和linux64版本,非常感谢 (5/1376) rh1127 2020-04-12 2020-04-14 06:47:52 by rh1127
[Gaussian] 高斯找过渡态 (8/2906) 悠哉2020 2020-04-12 2020-04-13 13:44:20 by 悠哉2020
[Gaussian] [已完结]gauss,chk文件 (1/628) ZπL鹏 2020-04-13 2020-04-13 12:47:24 by paramecium86
[Gaussian] [已完结]求一份64位Gaussian 09 D或E软件,和配套的GaussView 5软件,Win系统,非Linux版本。 (1/835) tianmafei 2020-04-06 2020-04-12 14:32:20 by magicrao
[Gaussian] [已完结]高斯计算的电荷和自旋多重度怎么求 (7/2580) 节能灯希望 2020-04-10 2020-04-11 18:14:46 by 节能灯希望
[Gaussian] [已完结]求助Gaussian09版本软件,谢谢! (6/1499) renxingye 2020-02-27 2020-04-10 11:08:00 by Linlujian
[其他] 求助有关量子点石墨烯最新综述 (16/1542) 野百合女青年 2017-05-22 2020-04-09 20:49:44 by dreameronAir
[Gaussian] [已完结]配体保护金属团簇激发态优化一直不收敛,请教大家! (2/781) 欧阳平平 2020-02-23 2020-04-09 19:59:12 by gxhgxh
[其他] [已完结]!!!有人有Torch构象搜索软件么或求助构象搜索软件都有哪些?还有安装包?十分感谢 (2/924) mayaoling 2020-04-09 2020-04-09 16:26:39 by mayaoling
[Gaussian] [已完结]如何在gaussview里面建立配位结构的模型? (1/1383) daodaoliu 2015-09-29 2020-04-09 13:26:52 by 记忆里的阳光
[Gaussian] 求gussian view软件windows (35/539) Jaggie.HNU 2020-04-08 2020-04-08 19:20:39 by xzw885130
[Gaussian] [已完结]高斯找过渡态,输出文件错误怎么解决?求大佬回复 (2/1058) 悠哉2020 2020-04-08 2020-04-08 17:12:37 by 悠哉2020
[Gaussian] [已完结][求助]求Linux版64位Gaussian09安装包 (7/1558) canaan1995 2019-10-30 2020-04-08 16:48:45 by AndyGreen
[Gaussian] 【求助】Defaulting to unpruned grid for atomic number 79 (7/5196) 296011136 2010-11-09 2020-04-08 13:48:37 by 节能灯希望
[Gaussian] [已完结]高斯输出软件出现错误,怎么解决 (1/459) 节能灯希望 2020-04-07 2020-04-07 21:39:03 by paramecium86
[Gaussian] [已完结]求Gaussian,Gaussview的windows版本,谢谢 (1/521) 就很酷啦 2020-04-06 2020-04-07 05:50:58 by paramecium86
[Gaussian] 高斯计算生成焓 (3/1881) bit2018 2020-04-05 2020-04-06 21:28:26 by bit2018
[Gaussian] [已完结]怎么解读homo和lomo分子轨道图?    ( 1 2 ) (11/9561) 晨曦2009127 2012-07-22 2020-04-05 15:49:21 by 异形杀手
[Linux应 ] 庆祝武汉四号线开通    ( 1 2 ) (54/2094) Nilman 2020-03-29 2020-04-03 11:01:16 by Cheerfulxx
[Gaussian] [已完结]gaussview 一阶超极化率 偶极矩 (5/1778) 记忆里的阳光 2020-04-02 2020-04-02 20:24:50 by oyljw
[Gaussian] [已完结][关贴]求gaussian09适用win10十分感谢各位虫友!!!! (0/397) qidirang 2020-04-02 2020-04-02 14:20:18 by qidirang
[Linux应 ] Linux操作系统基础使用教程    ( 1 2 3 ) (113/5089) whw.ustc 2013-09-08 2020-03-31 16:59:12 by tuzhenlong
[Gaussian] [已完结]gaussian (2/515) tinananaw 2020-03-29 2020-03-29 21:25:01 by paramecium86
[量化新手 ] 聚苯胺的热力学计算 (3/771) hywjj 2020-03-23 2020-03-29 20:07:51 by mikeshen101
[其他] [已完结]求助ECD计算!!!有人可以教我计算一下ECD么? (2/966) mayaoling 2020-03-28 2020-03-29 17:58:09 by mayaoling
[Gaussian] gaussian09显示2070错误 (2/1097) obsession。 2020-03-28 2020-03-28 22:32:19 by 天天进步啊
[量化新手 ] [已完结]求Gaussian09和Gaussionview的linux64版本 (4/1245) meimeihappy 2019-12-25 2020-03-28 14:30:09 by paramecium86
[Gaussian] [已完结][关贴]Gaussian软件 (8/1498) 水合二氧化硅 2020-03-05 2020-03-27 23:17:19 by 小李子来也
[Gaussian] [已完结]求一份Gaussian09D版本软件,最好有配套的gaussianview软件,win系统,64位 (2/684) heatgo123 2020-03-25 2020-03-26 21:15:14 by wuwenhao0
[Gaussian] 荧光寿命和辐射跃迁与非辐射跃迁的关系 (7/8390) leongfeng 2013-04-28 2020-03-26 07:47:56 by 卡普那奴
[Gaussian] [已完结]求支持老机子CPU的G09E01 linux 64位版 (4/719) bsbpl 2020-03-24 2020-03-25 15:23:21 by bsbpl
[Gaussian] [已完结]求老师指教一下高斯中的 Full Mulliken population analysis及Density Matrix吧 (1/1432) 路路lulu 2015-10-22 2020-03-25 08:09:58 by 柠夏半榭i
[Gaussian] [已完结]电荷陷阱大小 (0/613) pcyfighting 2020-03-24 2020-03-24 11:47:50 by pcyfighting
[量化图形 ] chemcraft    ( 1 2 ) (50/4607) 孙1986 2013-08-23 2020-03-20 07:12:29 by fzthappy
[Gaussian] Guassain版权 (3/659) 寒冻水成冰 2020-03-18 2020-03-18 20:12:32 by b3478518
[Gaussian] [已完结]高斯运算找不到指定文件 (9/3405) 城中木 2015-08-28 2020-03-17 16:39:43 by bixin521
[量化新手 ] 分子设计 (6/718) 非梦非实 2019-04-08 2020-03-15 23:25:41 by 无欲无念
[Turbomo ] 基组库    ( 1 2 ) (87/4264) ZDBWHZ 2011-09-26 2020-03-14 19:20:26 by SHJSHJ
[其他] [已完结]用Gaussian计算分子体积 (2/498) bit2018 2020-03-13 2020-03-13 21:57:15 by 莫落
[Gaussian] [已完结]计算终止,请教大家:g_write (6/1767) cenxueer 2020-03-12 2020-03-13 08:26:37 by cenxueer
[量化图形 ] [已完结]高斯计算转动光谱 (0/860) 山木易石94 2020-03-12 2020-03-12 10:25:33 by 山木易石94
[Gaussian] [已完结]高斯计算转动光谱 (6/2526) B612 2013-06-28 2020-03-12 07:19:09 by 山木易石94
[Gaussian] [已完结]计算机转动常数国际上规定精确到第几位? (7/1153) tudoudigua 2012-08-13 2020-03-12 07:08:16 by 山木易石94
[量化新手 ] [已完结]高斯从头算分子的转动常数 (3/1291) sunxueli87 2012-11-05 2020-03-12 06:55:51 by 山木易石94
[其他] 有机分子的激发态与光化学 (48/2293) hakuna 2014-11-23 2020-03-11 20:54:15 by 随缘stz
相关版块跳转
查看