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[Á¿»¯ÐÂÊÖ ] Á¿×Ó»¯Ñ§ ÀµÎÄ ÖÐÎÄ°æ    ( 1 2 3 4 5 6 .. 24 ) (1186/35965) ÀÏ_Ó¥ 2012-12-07 2025-02-23 15:17:54 by www1
[ÆäËû] E.G.Lewars£ºComputational Chemistry    ( 1 2 3 ) (140/6600) yjcmwgk 2014-01-09 2025-02-19 16:08:46 by zmj110
[¸öÈËÎļ¯] ¾²ÇÄÇÄ£¬»¯Ñ§¼üµÄ±¾ÖÊͳһÁË    ( 1 2 3 4 5 6 .. 9 ) (85/11392) zhou2009 2018-12-19 2025-02-18 18:45:09 by zhou2009
[ÆäËû] CP2K¼ÆËã·Ö×ÓÕñ¶¯¹âÆ×Çë½Ì (0/1714) Ã÷µÂóÆÑ§ 2025-02-13 2025-02-13 21:20:52 by Ã÷µÂóÆÑ§
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[ÆäËû] ¾«»ªIÎïÖʽṹѧϰָµ¼ µç×ÓÊé¼®    ( 1 2 3 4 5 6 .. 14 ) (657/18136) fishrose 2012-02-22 2025-02-12 13:00:46 by lisy2001
[Á¿»¯ÐÂÊÖ ] ·¢Ò»±¾Levine Quantum ChemistyµÄϰÌâ½â´ð µÚÆß°æ×îÐÂ°æ    ( 1 2 ) (67/5439) tonganlhy 2015-11-30 2025-02-10 07:48:37 by ypghnust61
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[ADF/Dal ] ADF´óÁ¿ËãÀý (42/2604) hakuna 2015-02-09 2025-01-29 17:01:18 by xiaoxiao136
[ADF/Dal ] ADFÈëÃż¼ÇÉPPTÒ»·Ý    ( 1 2 ) (67/3845) lastzealot 2016-11-05 2025-01-29 16:58:25 by xiaoxiao136
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[ÆäËû] Á½±¾µç×ÓÊé (10/1420) fenxijia 2015-11-25 2025-01-13 12:55:49 by wl7171759
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[Multiwfn] Çó´óÀÐ (0/1042) ·²ry 2025-01-04 2025-01-04 00:05:26 by ·²ry
[ÆäËû] Á¿»¯¿Î¼þ£¨ËÕÖÝ´óѧ£©    ( 1 2 3 4 5 ) (210/9610) xiaoyouzhi 2011-12-30 2025-01-03 10:01:09 by wangrui0517
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[NBO/AIM] ÈçºÎ¼ÆËãÓлúÀë×Ó»¯ºÏÎïµÄHOMOºÍLUMOÄܼ¶£¿ 5 (1/2771) lq57 2024-12-25 2024-12-26 12:30:40 by paramecium86
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[Á¿»¯Í¼ÐÎ ] ÇóAIMAll Version 19.10.12 800 (1/1728) CyclonLi 2020-07-07 2024-12-24 18:50:17 by xiaoai040
[Gaussian] ÖáÊÖÐÔ»¯ºÏÎïÐýתÄÜÀݼÆËã 60 (3/2974) ÄþÔ³¤·ç 2024-12-23 2024-12-23 20:58:53 by czyzsu
[Gaussian] ÇóÖúÉó¸å¹ØÓÚDFT calculation the criteria of the global PEC minima fulfilled? 30 (3/1504) maoxiao 2024-12-21 2024-12-22 19:19:12 by maoxiao
[Gaussian] ÄÜÀݼÆËã 50 (4/1541) ³æ³æ³åwa 2024-12-21 2024-12-22 11:27:52 by ³æ³æ³åwa
[LinuxÓ¦ ] M.L.Hetland£ºPython±à³Ì»ù´¡    ( 1 2 ) (90/5330) yjcmwgk 2014-01-09 2024-12-15 20:08:39 by tianwk
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[ÆäËû] ÍÅ´ØÈ«¾ÖÓÅ»¯Èí¼þABClusterµÄPPT½Ì³Ì (30/6857) coolrainbow 2016-11-04 2024-12-11 19:12:54 by timetozero
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[Gaussian] [ÒÑÍê½á]ÓÃgaussview²é¿´HOMOºÍLUMOµÄ¹ìµÀͼ    ( 1 2 ) (12/10729) ¹ÂÐÄ·¼·Æ 2014-03-20 2024-12-05 07:04:13 by ÔÂÏÂÁ÷ÐÇ
[ÆäËû] ÈçºÎÇø·ÖDexterÄÜÁ¿×ªÒƺÍÁ׹⹲ÕñÄÜÁ¿×ªÒÆ£¿ 10 (0/2479) yly150 2024-12-03 2024-12-03 10:30:20 by yly150
[Turbomo ] Ôõô»ùÓÚSTEOM-DLPNO-CCSD¼ÆËãrISC 2 (14/1961) hcmzj668 2024-11-25 2024-11-29 15:13:32 by ÔÂÒ¹·ç²¨
[Á¿»¯ÐÂÊÖ ] ¡¶»ù´¡Á¿×Ó»¯Ñ§ÓëÓ¦Óá·ÄÏ¿ª´óѧÁõ¾¸½®±àÖø£¨Ñ§Ï°¼ÆË㣬»¹ÊÇ»ù´¡´òÀÏÁËΪºÃ£©    ( 1 2 3 4 5 6 .. 17 ) (849/26427) gkf¸ß 2011-11-22 2024-11-27 07:16:09 by À¶É«¹þ´ï
[ÆäËû] ÉÏ´«¼¸±¾¾­µäµÄPhysical ChemistryÏà¹Ø½Ì²Ä    ( 1 2 3 4 5 6 ) (289/19625) º®ÓêÈËÉú 2014-03-27 2024-11-27 07:13:33 by À¶É«¹þ´ï
[Á¿»¯ÐÂÊÖ ] Á¿×Óɸ·ÖÇóÖú 200 (0/924) µÔÏþ¿­ 2024-11-25 2024-11-25 20:01:13 by µÔÏþ¿­
[ÆäËû] [ÒÑÍê½á]ÇóÖúÈí¼þ£ºwavefunction spartan 14 crack°æ¼°ÒÔÉϰ汾    ( 1 2 ) (16/8846) lihanghang 2022-08-22 2024-11-23 15:14:47 by ÁÖÀû±ò1992
[Gaussian] DFT¼ÆËãÖÐÈܼÁÑ¡Ôñ¶Ô·Ö×ÓµÄLUMO HUMOµÄÓ°Ïì (9/4527) dhppp 2024-11-16 2024-11-18 09:45:28 by dhppp
[Gamess/ ] ÇóÖú£¬¹ØÓÚ²¨º¯Êý¶Ô³ÆÐÔÓëż¼«¾ØµÄÎÊÌâ 20 (1/5161) luqing6879 2024-10-24 2024-11-09 08:52:51 by ÖпƿÆÓ¢002
[Gaussian] ¸ß˹ģÄâż¼«¾Ø 5 (2/1714) keyanyue 2024-08-10 2024-11-09 05:56:36 by ÖпƿÆÓ¢002
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[ÆäËû] ¼ª²¼Ë¹×ÔÓÉÄÜ 5 (1/1480) ²»Ë¯¾õ¾Å 2024-07-28 2024-11-05 10:36:00 by kayalu
[ÆäËû] ÕýÔòϵ×ÛµÄÇó½â (5/3560) Õå×ÃËðÒæ 2024-11-03 2024-11-03 16:50:32 by Wally0511
[ÆäËû] ÕýÔòϵ×ÛµÄÇó½â 5 (0/3044) Õå×ÃËðÒæ 2024-11-03 2024-11-03 16:21:52 by Õå×ÃËðÒæ
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[Multiwfn] µçºÉÃܶȷֲ¼Í¼ 20 (1/4042) ³æ³æ³åwa 2024-09-16 2024-10-22 11:42:30 by ÍõÏþ²¨985
[Gaussian] Ô²¶þÉ«Æ×ͼÔõô¿´µÄÄØ (14/5218) Qinhaobei 2024-10-17 2024-10-18 08:47:37 by gordon399
[ÆäËû] ¡¾ÈºÂÛ¡¿ÈºÂÛÔÚ»¯Ñ§ÖеÄÓ¦ÓÃ.¿Æ¶Ù.µÚ3°æ.ÖÐÎİæ (8/4275) ѧԱq7e5Vm 2023-06-17 2024-10-17 08:50:35 by putongwulixue
[LinuxÓ¦ ] [ÒÑÍê½á]Çólinux°ægaussian¼°ÅäÌ×µÄviewer (8/3255) m0378 2019-05-19 2024-10-16 08:18:26 by ÄǸöÖ´ÊÂØ¼
[Gaussian] ¼±ÇóLinux°æ64λGaussian09°²×°°ü»òGaussian16µÄ°²×°°ü 500 (3/3417) fuying 2024-07-20 2024-10-15 13:07:14 by liuxf222
[Á¿»¯Í¼ÐÎ ] sybyl-x 2С·Ö×Ó¹¹ÏóËÑË÷½Ì³Ì 100 (0/2553) ZEUSCJP 2024-10-15 2024-10-15 11:58:09 by ZEUSCJP
[ÆäËû] Materials Studio Åàѵ½Ì³Ì    ( 1 2 ) (57/7320) taopan1 2019-06-28 2024-10-12 12:23:49 by wghcsu
[Gaussian] ÇóÖú´óÉñ¹ØÓÚ¸ß˹Èí¼þ°æÈ¨µÄÎÊÌ⣿ 20 (1/3033) maoxiao 2024-10-11 2024-10-12 11:12:42 by paramecium86
[Gaussian] Exploring Chemistry With Electronic Structure Methods ÖÐÎĺÍÓ¢ÎÄ°æ    ( 1 2 3 4 5 6 .. 12 ) (571/23715) ·ãл»¨¿ª 2013-10-15 2024-10-08 15:01:46 by zhangfb
[Gaussian] [¹ØÌù]Çó gaussian-linux°æ±¾ Èí¼þ 400 (0/1594) zhangfb 2024-10-07 2024-10-07 14:44:17 by zhangfb
[Gaussian] ¸ß˹09°æÈ¨ÇóÖú 5 (1/2768) zhukairuo 2024-09-26 2024-09-27 10:55:18 by mt13
[Gaussian] ÇóÖú (1/1346) ѫ¹034 2024-09-26 2024-09-27 10:41:23 by mt13
[ÆäËû] ¡¾¾­µäÊé¼®¡¿¹ÌÌåÓë±íÃæ_»ô·òÂü (44/8565) KUICGO 2017-09-01 2024-09-24 07:30:28 by ngsefox
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[Gaussian] [ÒÑÍê½á]ÇóÖú´óÉñ¹ØÓÚgaussviewÔõôÉèÖø߷ֱæÂʵÄͼƬ (2/2922) maoxiao 2024-09-08 2024-09-11 11:16:25 by maoxiao
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[Gaussian] GaussianϵÁÐÈí¼þ½Ì³Ì    ( 1 2 3 4 5 6 .. 10 ) (487/23473) whw.ustc 2013-09-08 2024-09-04 05:44:57 by langzhi
[Gaussian] [ÒÑÍê½á]gaussian ÇóÖú (2/1663) scuwang 2014-05-21 2024-08-25 18:03:18 by polydopa
[Á¿»¯ÐÂÊÖ ] Exploring Chemistry With Electronic Structure Methods    ( 1 2 3 ) (124/8470) ·ãл»¨¿ª 2014-07-17 2024-08-21 14:16:57 by ngsefox
[Á¿»¯ÐÂÊÖ ] ¸ßµÈÎïÀí»¯Ñ§¿Î¼þ    ( 1 2 ) (82/5611) ÍõÖ¾³É003 2014-12-28 2024-08-21 07:13:11 by chengli5688
[ÆäËû] ÇóÖúCu-TCNQ¾§Ìå½á¹¹phase I ºÍ phase II£¬ÐèÒª.xsd¸ñʽ 100 (0/1965) xg1987 2024-08-20 2024-08-20 16:22:30 by xg1987
[ÆäËû] [ÒÑÍê½á]ÇëÎÊ·Ö×ӵĿ¼«¾ØÓ¦¸ÃÔõÑùµÃµ½£¿ (6/2097) °×ÓñԡѪ 2015-03-19 2024-08-15 11:32:22 by abcfeng
[Multiwfn] ×öÕâЩ¾ßÌåÓкÎÒâÒå (13/3689) 182135 2024-08-13 2024-08-14 16:31:11 by 182135
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[ÆäËû] ÓÖȱ½ð±ÒÁË£¬ÔÙÂôµãÊ飺Chem Rev·¢µÄÒ»ÆÚר¿¯£º¹ý¶É½ðÊôµÄÀíÂÛ¼ÆËã    ( 1 2 3 ) (103/5264) yjcmwgk 2014-05-23 2024-08-05 13:35:28 by СÐÜè8ºÅ
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[Á¿»¯ÐÂÊÖ ] [ÒÑÍê½á]×î¸ß×ÔÐý̬(HS) Óë¶Ô³ÆÐÔÆÆËð̬(BS) (3/1855) Ìì¿Õ²Ôñ· 2016-04-12 2024-07-31 17:40:33 by marbing
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[Gaussian] Çë½ÌECD£¬ÏëѧECD (15/3753) Qinhaobei 2024-07-07 2024-07-28 18:08:53 by xdllsq1314
[Á¿»¯Í¼ÐÎ ] chemcraft (1/2151) СÖíÅÝÅÝ 2023-11-19 2024-07-25 13:41:57 by zhoutl970
[Á¿»¯ÐÂÊÖ ] ÏëÎÊÎÊuuÃÇ£¬ÎïÖÊÖÊ×Ó»¯Ç°ºóÄÜÁ¿±ä»¯Ôõô¼ÆË㣿 (16/1671) Full_light 2024-07-17 2024-07-20 19:10:08 by czyzsu
[Á¿»¯ÐÂÊÖ ] ¾­µä×ÊÔ´ÖØ·¢----ͼ½âÁ¿×Ó»¯Ñ§-¸£¾®Ç«Ò» (7/372) paramecium86 2021-07-23 2024-07-20 04:55:11 by xian2008
[Molpro/ ] molpro¼ÆËãÖÐSCFÄÜÁ¿´íÎóµØÊÕÁ²µ½½Ï¸ßµÄ̬ 110 (2/3049) 1466036890 2023-06-09 2024-07-10 10:28:28 by yongleli
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[Gaussian] [ÒÑÍê½á]ÇóÖúGauss03¿¼ÂÇÈܼÁ»¯×÷ÓÃÏÂËãA+B=ABµÄ½áºÏÄÜ (4/1152) kaluoyi2008 2012-06-02 2024-06-28 13:27:33 by paramecium86
[Multiwfn] MultiwfnÓ벨º¯Êý·ÖÎö¼ò½é    ( 1 2 3 4 ) (172/8939) sobereva 2014-06-19 2024-06-22 19:53:32 by cfocus20
[Á¿»¯ÐÂÊÖ ] ¹ÌÌåÁ¿×Ó»¯Ñ§¡ª¡ª²ÄÁÏ»¯Ñ§µÄÀíÂÛ»ù´¡ (33/3866) à½à½²»³ÔÌÇ 2020-08-27 2024-06-21 17:21:22 by hxzhang1982
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[Á¿»¯ÐÂÊÖ ] gaussian09Ìá½»ÈÎÎñʱºò±¨´í 10 (2/1435) cxq2002 2024-06-01 2024-06-01 21:32:39 by paramecium86
[Gaussian] ÇóGaussianÊ¥¾­exploring chemistry 2nd ËãÀý 6 (4/1629) Ë®ÖÐÓÐÃ÷Ô 2024-04-14 2024-05-31 14:18:33 by Iduo417063
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