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[热点] 博士申请 焦晓明 2026-05-24 刚刚
[Gaussian] 高斯计算问题 10 (1/1300) 666... 2024-01-14 2024-01-14 23:16:16 by paramecium86
[Gaussian] 求助Gaussian16消虚频小程序，谢谢，金币不够再加。 55 (1/1107) lujun2910 2024-01-14 2024-01-14 22:37:16 by lujun2910
[Gaussian] 探索化学的奥秘，电子结构方法 (2/1457) machunyude 2024-01-10 2024-01-11 00:28:06 by machunyude
[Gaussian] [已完结]高斯计算问题 (4/1573) 666... 2024-01-09 2024-01-10 13:51:32 by paramecium86
[Gaussian] 高斯计算问题 50 (2/1475) 666... 2024-01-07 2024-01-08 12:29:31 by 666...
[Gaussian] [已完结]总是link died，然后错误的原因在图片中 (3/2214) 03155617021 2023-11-15 2024-01-07 21:45:20 by 03155617021
[Gaussian] TS过渡态 10 (2/1359) 虫虫冲wa 2023-12-29 2023-12-30 22:24:02 by 虫虫冲wa
[Gaussian] 四齿配体配位的Ru化合物的配位数与自旋多重态的疑问 5 (2/2139) zhuyoucai 2023-09-01 2023-12-21 08:56:58 by 冀台村001
[Gaussian] 柔性扫描 10 (1/1445) 虫虫冲wa 2023-12-14 2023-12-14 15:15:42 by paramecium86
[Gaussian] 分子筛建模结构优化前如何固定部分原子？ 30 (1/1511) 可以毕业吗 2023-11-21 2023-12-07 17:58:31 by 天天进步啊
[Gaussian] [已完结]求Gaussian09/16 ,gaussview windows版本安装包 (7/3575) liuchun521 2020-04-28 2023-12-04 10:08:50 by xyf9526
[Gaussian] 【求助】Fukui计算N-1出错，报错提示是l502.exe 程序错误，不知何解，求帮助 50 (1/1905) 秋风沐雨 2023-12-03 2023-12-03 23:35:05 by paramecium86
[Gaussian] [已完结]垂直电子亲和能怎么计算 (5/1799) sunday6392 2023-11-28 2023-11-29 08:08:44 by sunday6392
[Gaussian] 计算报错 10 (1/1349) 虫虫冲wa 2023-11-28 2023-11-28 16:29:18 by paramecium86
[Gaussian] 过渡金属配合物磷光振动分辨光谱计算的求助 100 (2/1771) yes.and. 2023-04-21 2023-11-27 05:47:32 by 竖走的螃蟹
[Gaussian] gaussian续算 10 (4/1773) 虫虫冲wa 2023-11-24 2023-11-26 11:20:53 by 虫虫冲wa
[Gaussian] Chemcraft软件 10 (8/3412) lzn151 2022-02-19 2023-11-20 19:14:36 by 小猪泡泡
[Gaussian] 计算化学 (2/1305) 虫虫冲wa 2023-11-17 2023-11-17 17:25:39 by 虫虫冲wa
[Gaussian] SN1反应势能面扫描 10 (2/1432) 虫虫冲wa 2023-11-11 2023-11-15 17:06:10 by 虫虫冲wa
[Gaussian] 自旋多重度 10 (2/1293) 虫虫冲wa 2023-11-04 2023-11-08 15:31:10 by 虫虫冲wa
[Gaussian] 势能面扫描 10 (1/1472) 虫虫冲wa 2023-10-01 2023-10-06 01:25:38 by paramecium86
[Gaussian] 量子化学基础 分子轨道 HF理论 (0/1418) 学员90J8YK 2023-09-30 2023-09-30 08:33:06 by ZWLweilai
[Gaussian] 高斯计算吸附能 60 (2/2236) sjshhe 2023-08-30 2023-09-27 14:20:47 by mo春春Cc
[Gaussian] 怎么使用chk文件继续进行被中断的计算呢？ (14/5984) 1773258 2022-10-11 2023-09-27 11:17:10 by mo春春Cc
[Gaussian] 结构优化 5 (3/1753) 虫虫冲wa 2023-09-25 2023-09-27 09:11:02 by mo春春Cc
[Gaussian] 求助 10 (2/1322) 虫虫冲wa 2023-09-21 2023-09-23 05:40:10 by 虫虫冲wa
[Gaussian] 求助：gauss 单点能 中断后还能继续算么？ 30 (9/4308) aaq2800 2020-10-16 2023-09-18 05:07:26 by aaq2800
[Gaussian] 求gaussview6的gmmx模块Windows版！ 5 (5/3046) 山水ww 2022-12-22 2023-09-10 17:58:01 by csyy123
[Gaussian] 2070错误 10 (1/1825) 甜甜美美zh 2023-09-08 2023-09-09 20:56:37 by paramecium86
[Gaussian] 重组能分解 (10/1241) 皮卡77 2023-09-08 2023-09-08 21:47:19 by ATLANTS
[Gaussian] [已完结]过渡态搜索 (3/2786) myw123456 2020-11-14 2023-09-04 10:44:44 by liuliuHPC
[Gaussian] [已完结]高斯计算caspt2 (3/4724) lu589 2019-03-18 2023-08-12 12:13:07 by 1234zou
[Gaussian] 关于NPA电荷分析反应位点 5 (0/1252) 爱吃山竹a 2023-08-11 2023-08-11 18:59:19 by 爱吃山竹a
[Gaussian] 求助GaussianVeiw安装包及安装教程 20 (2/1763) fanjiayun 2022-10-02 2023-08-07 20:45:58 by mhsyzhr
[Gaussian] gaussian 16W 打开gif文件显示报错193、1400，输出文件空白，怎么解决呀 5 (3/2105) youang 2023-07-20 2023-07-31 18:56:39 by qhding
[Gaussian] [关贴]各位大神，求助windows 10操作系统的高斯09软件和配套的gaussview 20 (0/1262) maoxiao 2023-07-28 2023-07-28 14:45:27 by maoxiao
[Gaussian] 离子化合物模型构建 15 (6/2037) acerabc 2023-07-06 2023-07-08 07:57:05 by shenrenren
[Gaussian] 求助，找过渡态大佬，很听劝 (5/2181) 一只鳥啊 2023-04-11 2023-07-07 06:25:46 by 陈俊飞
[Gaussian] 菜鸟求助 (4/659) 我是雷哥 2016-08-30 2023-07-05 06:39:24 by 想有个学上攸
[Gaussian] [已完结]有偿求助高斯计算有机小分子鎓盐的单三线态能级差的详细步骤 (5/3017) wl19911119 2020-03-17 2023-07-04 01:00:21 by paramecium86
[Gaussian] [已完结]为什么优化后的苯环大π键变成了双键 (3/1485) muxiachuixue 2011-11-18 2023-07-02 12:53:56 by 19960530
[Gaussian] 3s3p2d2f 收缩基组指的是什么 20 (0/1106) 还想努力 2023-06-17 2023-06-17 22:12:58 by 还想努力
[Gaussian] gaussian入门资料    ( 1 2 3 ) (129/10129) haifengshi 2012-10-18 2023-06-05 15:13:02 by awmc2008
[Gaussian] 计算转移积分和重组能 20 (2/1758) 阳光下的祝福 2021-03-27 2023-05-26 06:38:59 by Dwj40520
[Gaussian] DP4+ (1/1599) 语过添情1 2021-12-28 2023-05-25 22:23:01 by Weiliang
[Gaussian] 2023年南京大学理论与计算化学暑期学校 (0/1080) guoxuehui 2023-05-23 2023-05-23 09:27:01 by guoxuehui
[Gaussian] 谁有gaussian09W E01的版本 50 (2/1146) aaq2800 2023-04-20 2023-05-22 20:37:51 by paramecium86
[Gaussian] 在天河二号上配置及使用不带Linda的Gaussian09    ( 1 2 ) (评阅+4) (13/3024) 下个ID见咯 2016-03-21 2023-05-20 08:18:35 by 一而三思
[Gaussian] [已完结]TD-DFT计算结果问题 (3/1550) Noiost 2023-05-19 2023-05-19 18:26:39 by paramecium86
[Gaussian] 量子化学计算软件 (0/1327) XII3049gYo 2023-05-18 2023-05-18 17:18:03 by XII3049gYo
[Gaussian] Gaussian计算分子前线轨道能量 10 (3/1268) LYCMY 2023-05-11 2023-05-12 00:20:58 by paramecium86
[Gaussian] 求分享一个GaussView的GMMX模块的win版安装包 28 (1/1248) direntian 2023-05-10 2023-05-10 15:16:17 by 山水ww
[Gaussian] 小白发问 (4/1307) shouwu_he 2023-05-09 2023-05-10 10:39:24 by shouwu_he
[Gaussian] 高斯bomd中的randomvelocity (2/1282) 皮卡77 2023-04-25 2023-05-09 19:29:30 by 皮卡77
[Gaussian] 【求助】标准生成热Qf与Gaussian计算的标准生成焓ΔHf不对应 10 (8/2456) PBX9502 2023-05-07 2023-05-09 12:38:55 by PBX9502
[Gaussian] NBO轨道分析 20 (1/1085) 呆瓜呀呀 2023-05-08 2023-05-08 16:41:20 by 895833639
[Gaussian] Gaussian溶剂化 10 (2/1614) LYCMY 2023-05-07 2023-05-08 13:55:28 by LYCMY
[Gaussian] 投票:  【讨论】常用Gaussian的朋友过来投票：你常用的基组是什么？    ( 1 2 3 4 5 ) (评阅+5) (42/16883) yjcmwgk 2009-08-19 2023-05-06 12:51:45 by magicrao
[Gaussian] 稳定性分析 10 (0/796) 661288 2023-05-05 2023-05-05 10:23:03 by 661288
[Gaussian] 极化率 10 (2/1134) 661288 2023-04-28 2023-05-01 09:27:58 by lucent
[Gaussian] [已完结]CCSD(T) 内坐标 L114错误    ( 1 2 ) (11/3537) _Smile_ 2015-06-07 2023-04-27 06:58:53 by 执念断念
[Gaussian] Gaussian09w在打开过程中总是自动闪退，系统是win11+锐龙u. 5 (4/1967) 戒骄戒躁+ 2023-04-11 2023-04-25 15:11:59 by 895833639
[Gaussian] Gaussian软件包 (1/1228) panaggg 2023-04-07 2023-04-25 14:46:08 by 895833639
[Gaussian] 高斯安装参考 (0/1044) 不会做计算的相� 2023-04-25 2023-04-25 11:43:39 by 895833639
[Gaussian] 高斯 5 (2/1135) 啵啵是大哥 2023-04-23 2023-04-24 08:44:46 by 啵啵是大哥
[Gaussian] [已完结]chk文件的HOMO和LUMO的电子云分布图看不了，急求帮助 重谢 (7/2211) 啄木鸟zyc 2015-06-15 2023-04-23 17:02:00 by 啵啵是大哥
[Gaussian] [已完结]为什么高斯算的偶极矩方向与实际情况相反呢？    ( 1 2 ) (16/5287) zhangl2011 2016-03-04 2023-04-20 14:13:29 by R507216421
[Gaussian] 【求助】关于用gview做静电势能表面图 (3/1362) zerozyz 2010-09-11 2023-04-19 14:30:00 by 教心教心
[Gaussian] 【交流】高斯简单基组函数介绍    ( 1 2 ) (10/2107) liuzhencc 2008-05-26 2023-04-17 08:06:41 by zchrainbow
[Gaussian] 结构优化出现2070错误 10 (3/2127) 661288 2023-04-12 2023-04-14 03:12:06 by paramecium86
[Gaussian] 本科毕设Gaussian的DFT一般计算多久算正常时间 10 (2/2157) LYCMY 2023-03-21 2023-04-11 19:32:17 by 王王犁
[Gaussian] 请教各位大神，怎么计算金属配位聚合物一个配位单元的LUMO和HOMO (23/1758) JYJ0425 2023-03-15 2023-03-24 10:48:42 by 云在青天
[Gaussian] [已完结]算103个原子结构优化要多久    ( 1 2 ) (12/4088) 601的大王 2022-05-08 2023-03-16 10:28:34 by EsperanzaM
[Gaussian] 量子化学计算方法    ( 1 2 3 4 ) (181/8082) wyhzj1987 2011-11-10 2023-03-16 07:25:25 by ypghnust61
[Gaussian] [已完结]求助：ST能量计算在914.Exe阶段终止，是否是内存问题，如何解决？ (4/1351) Noiost 2023-03-14 2023-03-15 14:47:46 by Noiost
[Gaussian] CCSD(T)算单点时HF不收敛，但是HF直接算单点收敛 66 (1/914) youxx189 2023-03-14 2023-03-15 09:49:37 by paramecium86
[Gaussian] 高斯软件如何看剩余计算时间 (3/1628) sth001 2023-03-07 2023-03-11 03:08:14 by paramecium86
[Gaussian] 高斯优化分析结构一直在进行 20 (2/1325) LLW199 2023-03-10 2023-03-11 03:06:42 by paramecium86
[Gaussian] Gaussian 09引用信息如何用Endnote导入 20 (1/1323) 计算高斯 2023-03-08 2023-03-09 08:46:11 by paramecium86
[Gaussian] 高斯问题出现2070问题 20 (2/1320) 辰未爱吃糖 2023-02-23 2023-02-24 07:47:10 by 辰未爱吃糖
[Gaussian] Gaussian计算生成热然的一个教程中，居然发现计算的例子错了，请高手进来指点迷津？ 10 (3/1129) iamlongwei 2023-02-22 2023-02-23 11:07:38 by iamlongwei
[Gaussian] 求助Gaussian计算生成热然后到材料的感度的相关计算问题？求高手帮忙进来指点，谢谢。 20 (1/839) iamlongwei 2023-02-18 2023-02-19 13:56:42 by paramecium86
[Gaussian] [已完结]电荷数和自选多重度设置问题 (2/1266) john_39842 2022-12-29 2023-02-15 15:21:56 by bxy-07
[Gaussian] 新手求助；吸附能计算；CO2；掺氮碳 5 (5/1419) longyonx 2023-02-05 2023-02-07 21:28:58 by paramecium86
[Gaussian] [已完结]新手求助Gaussian计算中算法问题 (2/872) xiaofeie 2023-02-04 2023-02-04 21:31:34 by xiaofeie
[Gaussian] 【求助】电荷转移积分的计算    ( 1 2 ) (10/5298) huixia2010 2010-08-24 2023-02-03 20:27:08 by mahl005
[Gaussian] ubuntu装gaussian09 (1/1332) lmylqh 2013-06-05 2023-01-23 09:30:51 by lgygdx
[Gaussian] 求助有机分子载流子传输积分， 5 (0/660) mahl005 2023-01-17 2023-01-17 14:41:26 by mahl005
[Gaussian] [已完结]求Gview 中的AMPAC模块 安装包 (7/1763) 心橙dream 2020-02-14 2023-01-17 09:31:56 by iamlongwei
[Gaussian] Gaussian可以进行分子筛的吸附模拟吗 (1/824) Kuroha丶 2023-01-15 2023-01-15 16:31:51 by ohnesie
[Gaussian] 关于怎么计算BDE的文献    ( 1 2 ) (61/3950) 飞行鸟 2012-10-12 2023-01-15 09:21:17 by 乔BWV
[Gaussian] 急求gaussian 09 linux 64 位安装包 (15/928) Able孤 2022-06-13 2023-01-14 08:51:53 by lgygdx
[Gaussian] Gaussian 5 (2/1040) 甜甜美美zh 2023-01-06 2023-01-11 22:15:14 by 元气少女TT
[Gaussian] 同分异构体的DFT计算 25 (3/1075) Forever0714 2022-12-18 2023-01-11 07:59:11 by 一只会
[Gaussian] DFT计算（CoGEF） 10 (3/2994) 蚂蚁奔跑 2021-03-26 2022-12-29 16:44:22 by 686810WQ
[Gaussian] [已完结][关贴]求linux版的Guassian09或者Guassian03安装包，可发邮箱624424997@qq.com，非常感谢！ (0/604) 羊羊甜点屋0 2022-12-13 2022-12-13 16:05:49 by 羊羊甜点屋0
[Gaussian] Gaussian求助 (7/671) MUZIM 2022-12-07 2022-12-07 14:58:50 by XG-WUST
[Gaussian] [已完结][求助]求windows 10操系统的高斯09软件和配套的gaussview    ( 1 2 3 ) (23/3827) mt13 2020-01-09 2022-12-03 09:00:21 by mt13
[Gaussian] 有机大分子用什么软件计算 5 (3/1115) 987645 2022-11-28 2022-11-29 18:23:48 by paramecium86
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