°æ¿éµ¼º½
ÕýÔÚ¼ÓÔØÖÐ...
¿Í»§¶ËAPPÏÂÔØ
ÂÛÎĸ¨µ¼
É격¸¨µ¼
怬
×¢²á
Ìû×Ó
Ìû×Ó
Óû§
±¾°æ
24СʱÈÈÃŰæ¿éÅÅÐаñ
>
³æÓÑ»¥Ê¶
(54)
>
¿¼²©
(18)
>
ÂÛÎĵÀºØÆí¸£
(6)
>
ÎÄÏ×ÇóÖú
(6)
>
˶²©¼ÒÔ°
(4)
>
¹«Åɳö¹ú
(4)
>
¿¼ÑÐ
(4)
>
µ¼Ê¦ÕÐÉú
(3)
>
½Ìʦ֮¼Ò
(3)
>
ÐÝÏйàË®
(3)
>
µÚÒ»ÐÔÔÀí
(2)
>
»ù½ðÉêÇë
(2)
>
ÂÛÎÄͶ¸å
(2)
>
רҵÍâÓï
(1)
>
·ÃÎÊѧÕß
(1)
>
²©ºóÖ®¼Ò
(1)
ÉêÇëµ±°æÖ÷
|
´æµµÇø
|
Ó¦ÖúÅÅÐÐ
|
QCÇ¿ÌûÅÅÐÐ
Сľ³æÂÛ̳-ѧÊõ¿ÆÑл¥¶¯Æ½Ì¨
»
¼ÆËãÄ£ÄâÇø
»
Á¿×Ó»¯Ñ§
¶©ÔÄ
¹ÜÀíÍŶÓ
(½ð±Ò¿â
106923
³äÖµ
)
Ö÷¹ÜÇø³¤£º
ÔÂÖ»À¶
Сºì¶¹
Ö÷¹Ü°æÖ÷£º
zhou2009
paramecium86
½Ü³ö¹±Ï×Õß
ר¼Ò¹ËÎÊ£º
beefly
jiewei
ggdh
¿¨¿ª·¢·¢
dxcharlary
jpchou
ÈÙÓþ°æÖ÷£º
lei0736
zzgyb
wuli8
aylayl08
nono2009
fegg7502
zzy870720z
uuv2010
csfn
Óù½£½ºþ
yjcmwgk
gmy1990
ben_ladeng
cenwanglai
ljw4010
ÈÙÓþ³ÉÔ±£º
erylingjet
heyo_123
gkf¸ß
5855
13/59
Ê×Ò³
ÉÏÒ»Ò³
11
12
13
14
15
16
ÏÂÒ»Ò³
È«²¿
ÎÄÕ¹ÊÊÂ
¸öÈËÎļ¯
Gaussian
Á¿»¯Í¼ÐοÉÊÓ»¯Èí¼þ
NBO/AIM
ADF/Dalton
Molpro/Molcas
Gamess/Q-Chem
HyperChem/NWChem
ChemOffice
Multiwfn
Turbomole/ORCA
SAPT/AOMix/Swizard
Semi-empirical
Á¿»¯ÐÂÊÖֱͨ³µ
LinuxÓ¦ÓÃ
ÆäËû
°æÎñ
´æµµËµÃ÷
Ìáʾ£ºÄúĿǰä¯ÀÀµÄÊDZ¾°æ¿é´æµµÇøµÄÌû×ÓÁÐ±í¡£
µã»÷ÕâÀï½øÈë±¾°æ¿é×îÐÂÁбí
»ØÌûÅÅÐò
·¢±íÅÅÐò
Ë¢ÐÂÒ³Ãæ
|
½»Á÷
|
ÇóÖú
|
×ÊÔ´
¾«»ªÇø
×÷Õß
×îºó·¢±í
[
Èȵã
]
¶ÔÂȱ½ÅðËá´¿»¯
ì¢ÅäÌå¹ó½ðÊô´ß»
2026-01-14
¸Õ¸Õ
[
Gaussian
]
¡¾ÇóÖú¡¿²»ºÃÒâ˼Âé·³ÁË¡£¡£¡£
(
1
2
)
(ÆÀÔÄ-2)
(13/1021)
holysong
2009-12-09
2009-12-10 21:07:11
by
holysong
[
Á¿»¯ÐÂÊÖ
]
¡¾ÇóÖú¡¿GSµÄ·½·¨£¬»ìºÏ»ú×é¼°Ô×ӹ̶¨Í¬Ê±½øÐÐ
(3/615)
yrclq
2009-12-10
2009-12-10 16:19:47
by
alixing
[
ÆäËû
]
¡¾ÌÖÂÛ¡¿¡°ÀíÂÛ»¯Ñ§ÔÀíÓëÓ¦Óã¨Ë§Ö¾¸ÕµÈÖø£©¡±Õâ±¾ÊéÔõôÑù£¿
(
1
2
)
(ÆÀÔÄ+3)
(19/1592)
yzcluster
2009-11-14
2009-12-10 14:42:07
by
loovfnd
[
°æÎñ
]
¡¾ÆäËû¡¿×£ºØGrasaVampiroµ£Èα¾°æ°æÖ÷£¨¸úÌû½ð±Ò100·¢·ÅÖС£¡£¡££©
(
1
2
3
4
)
(36/1117)
csfn
2009-12-07
2009-12-10 14:32:59
by
tudy9662
[
Gaussian
]
¡¾ÇóÖú¡¿Çë½Ì£ºÎªÊ²Ã´¼ÆËãµÄÒ»¸öÎȶ¨ÎïÖÐÀÏÊdzöÏÖÐ鯵Ĩ£¿
(7/592)
lfengxia82
2009-12-08
2009-12-10 14:25:04
by
³æ¶ù·ÉÀ´
[
Gaussian
]
¡¾ÇóÖú¡¿ÓÃGaussianÈí¼þÈçºÎ¼ÆËãÓлú»¯ºÏÎïµÄpKaÖµ
(5/1389)
flyrain37
2009-12-01
2009-12-10 10:21:25
by
lihb734
[
Gaussian
]
¡¾ÌÖÂÛ¡¿Öظ´±ðÈ˵Ť×÷Ϊʲô¸ù±¾Öظ´²»³öÀ´°¡
(
1
2
)
(ÆÀÔÄ+1)
(13/1263)
lixf
2009-12-01
2009-12-10 09:45:38
by
lixf
[
Gaussian
]
¡¾ÇóÖú¡¿ÔõÑù½â¾öBSSEУÕý³öÏÖl1´íÎó
(2/307)
fwenling0506
2009-12-09
2009-12-10 09:45:08
by
fwenling0506
[
NBO/AIM
]
¡¾ÌÖÂÛ¡¿AIM in Gaussian
(ÆÀÔÄ+3)
(8/1275)
yongleli
2009-09-03
2009-12-10 00:44:12
by
beefly
[
Gaussian
]
¡¾ÌÖÂÛ¡¿¼ÆËã¹ý¶É̬µÄ²½Ö裡£¡
(2/386)
hzfish
2009-11-23
2009-12-10 00:42:00
by
ggdh
[
Gaussian
]
¡¾ÇóÖú¡¿Gaussian 09ÔõôÓÅ»¯¼¤·¢Ì¬µÄ¹¹ÐÍ£¨ÃüÁîÐÐÈçºÎд£©£¿
13
(4/703)
xtdut
2009-11-28
2009-12-10 00:37:25
by
ggdh
[
°æÎñ
]
¡¾°æÎñ¡¿×¨¼ÒÃÇÀ´Á칤×ÊÀ²£¨²¹2009.10-11Á½¸öԵŤ×Ê£©
(
1
2
3
)
(20/1210)
yjcmwgk
2009-12-08
2009-12-09 22:30:06
by
lihb734
[
Gaussian
]
¡¾ÇóÖú¡¿gaussianÔËÐÐÖпDzãµÄÑ¡ÔñÎÊÌâ
(6/722)
zhanping
2009-12-08
2009-12-09 21:49:55
by
375642546
[
Gaussian
]
¡¾ÇóÖú¡¿DisplacementÓÅ»¯²»ÊÕÁ²ÔõÈçºÎ´¦Àí?
(6/880)
loovfnd
2009-11-30
2009-12-09 19:44:03
by
Jasminer
[
Á¿»¯ÐÂÊÖ
]
¡¾ÇóÖú¡¿ÎªÉ¶Á½¸öµØ·½Ëã³öÀ´µÄ½á¹û²î¾àÕâô´ó
(ÆÀÔÄ+1)
(7/561)
ISYS
2009-12-02
2009-12-09 17:17:46
by
wangxiu404
[
Semi-em
]
¡¾ÇóÖú¡¿¸ß˹ÖÐÓðë¾Ñéʱ³öÏÖ402´íÎóÔõô½â¾ö£¿
(2/482)
loovfnd
2009-11-27
2009-12-09 13:50:55
by
heyo_123
[
NBO/AIM
]
¡¾ÇóÖú¡¿ÓÐûÓзÖ×ÓµÄÔ×ÓµçºÉÖµÓÐʵÑéÖµ£¿
(4/811)
huangshp
2009-12-07
2009-12-09 10:58:47
by
wangxiu404
[
Gaussian
]
¡¾ÇóÖú¡¿ËãTD³ö´í
(2/391)
nanasj
2009-12-04
2009-12-09 09:43:58
by
nanasj
[
Gaussian
]
¡¾ÇóÖú¡¿»¯ºÏÎïÉÏÔ×ӵĵ縺ÐÔÔõô¼ÆË㣿
5
(1/393)
zhangdi6802
2009-12-08
2009-12-09 08:02:05
by
zhou2009
[
Gaussian
]
¡¾ÇóÖú¡¿gaussian03¼ÆËãÍ¬Î»ËØ»¯Ñ§Î»ÒÆ
(2/414)
freyfish
2009-12-08
2009-12-08 19:13:27
by
freyfish
[
Gaussian
]
¡¾ÇóÖú¡¿ÇëÎʳöÏÖl508´íÎóÓ¦Ôõô½â¾ö£¿
(6/884)
ltxnwu
2009-12-02
2009-12-08 18:55:54
by
yjcmwgk
[
Á¿»¯ÐÂÊÖ
]
¡¾ÇóÖú¡¿atomic population ²¼¾ÓµÄº¬Òå
(1/465)
chemobase
2009-12-05
2009-12-08 18:18:20
by
zhou2009
[
Gaussian
]
¡¾ÇóÖú¡¿¹ý¶É̬ÎÊÌâ
5
(3/453)
niuwenyu86
2009-12-08
2009-12-08 17:30:26
by
quantumor
[
Á¿»¯ÐÂÊÖ
]
¡¾ÇóÖú¡¿¼ÆË㻯ѧÈçºÎѰÕÒ·½ÏòÎÊÌâ
(2/379)
3867826
2009-12-04
2009-12-08 17:00:44
by
loovfnd
[
Á¿»¯ÐÂÊÖ
]
¡¾ÇóÖú¡¿ÇóÖú£º±à³ÌÐòÓöµ½Á½¸öÎÊÌâ лл
(1/425)
pizi7880
2009-12-06
2009-12-08 13:39:29
by
coolrainbow
[
Á¿»¯Í¼ÐÎ
]
¡¾ÇóÖú¡¿¹ØÓÚgviewÖÐ×ø±êµÄת»»ÎÊÌâ
(2/457)
lifei_dut
2009-12-03
2009-12-08 13:37:52
by
lifei_dut
[
Gaussian
]
¡¾ÇóÖú¡¿¹ØÓÚGausson 03 µÄÒ»¸öÎÊÌâ
(ÆÀÔÄ+1)
(6/840)
shontao
2009-11-10
2009-12-08 11:01:23
by
hzfish
[
Á¿»¯ÐÂÊÖ
]
¡¾ÇóÖú¡¿ÐÂÊÖÇë½ÌÁ¿×Ó»¯Ñ§Êé¼®
(
1
2
)
(ÆÀÔÄ+5)
(10/847)
Ptolomaeus
2009-12-05
2009-12-08 09:32:02
by
sheskybird
[
Gaussian
]
¡¾ÇóÖú¡¿ÇóÖúbppm¾§ÌåµÄcifÎļþ
2
(0/115)
zhangwc5020
2009-12-08
2009-12-08 09:28:14
by
zhangwc5020
[
Á¿»¯ÐÂÊÖ
]
¡¾ÇóÖú¡¿·ÒëÇóÖú
(2/203)
dreamyeye
2009-12-07
2009-12-08 08:25:27
by
yalefield
[
Gaussian
]
[ר¼Ò]
¡¾ÌÖÂÛ¡¿×ö·¼»·µÄpi¶Ñ»ýÓõķ½·¨
(3/412)
jiewei
2009-12-07
2009-12-08 02:06:41
by
neweroica
[
Gaussian
]
¡¾ÌÖÂÛ¡¿ÈçºÎ´Ó¼ü³¤ÅжÏÁ½¸öÔ×Ó¼äÊÇ·ñ³É¼üÄØ£¡
(8/1998)
kaluoyi2008
2009-06-13
2009-12-08 01:11:45
by
beefly
[
Gaussian
]
¡¾ÌÖÂÛ¡¿HF-roothaan·½³Ì½üËÆ¼ÆËãµÄÀí½â
3
(0/173)
zhangwc5020
2009-12-07
2009-12-07 21:29:08
by
zhangwc5020
[
Gaussian
]
¡¾ÇóÖú¡¿Õâ¸öÄ£ÐÍÔõô½¨Á¢£¿£¿
20
(0/350)
»ÆËæ±ã
2009-12-07
2009-12-07 21:29:03
by
»ÆËæ±ã
[
Gaussian
]
¡¾ÇóÖú¡¿Õâ¸öÊDZíʾʲôÒâË¼ÄØ£¿ÓÅ»¯ºóµÄ½á¹û¡£
(
1
2
)
(10/927)
gonemrc
2009-12-05
2009-12-07 19:58:26
by
neweroica
[
Gaussian
]
¡¾ÇóÖú¡¿ÄÄλºÃÐÄÈËÄܸøÎÒ·¢¸öGaussian03Èí¼þÂð£¿
(2/340)
caolijun5
2009-12-05
2009-12-07 19:43:26
by
caolijun5
[
ÆäËû
]
¡¾ÇóÖú¡¿Ò»¸öԾǨ·å¶ÔÓ¦¶à¸öԾǨ·½Ê½£¬ÎªÊ²Ã´£¿
(3/635)
375642546
2009-12-07
2009-12-07 17:25:31
by
lihb734
[
Gaussian
]
¡¾ÇóÖú¡¿Pd µÄ»ù×é
(4/262)
bents
2009-12-03
2009-12-07 16:58:12
by
bents
[
Multiwfn
]
¡¾ÇóÖú¡¿ÈçºÎÈÎÒâѡȡ¸ñµã´óС
(2/249)
wuy069
2009-12-04
2009-12-07 15:38:31
by
zhou2009
[
ADF/Dal
]
¡¾ÌÖÂÛ¡¿ADFƵÆ×
(0/169)
zhanping
2009-12-07
2009-12-07 15:32:50
by
zhanping
[
Gaussian
]
¡¾ÇóÖú¡¿Warning: center 10 has no basis functions!
(
1
2
)
(10/1404)
xiaofen
2009-12-05
2009-12-07 09:14:42
by
xiaofen
[
ÆäËû
]
¡¾ÇóÖú¡¿ÈçºÎÖ±¹Û»¯Ã¿¸ö¹ìµÀ³É·Ö
(5/733)
tiechong
2009-12-04
2009-12-07 06:25:38
by
tiechong
[
Gaussian
]
¡¾ÇóÖú¡¿¸ß˹¼¤·¢Ì¬³öÏÖÐ鯵£¬ÈçºÎ½â¾ö£¿£¿
(ÆÀÔÄ+1)
(6/991)
½ÌʦÁõ810
2009-12-03
2009-12-06 23:17:42
by
½ÌʦÁõ810
¡¾ÇóÖú¡¿GuassionºÍGuassView
(0/500)
shontao
2009-12-06
2009-12-06 18:26:15
by
shontao
¡¾ÇóÖú¡¿ÇëÎÊ·Ö×Ó¹ìµÀÈçºÎ»
(ÆÀÔÄ+1)
(5/504)
linhuisnd
2009-11-05
2009-12-06 17:13:54
by
fegg7502
[
Gaussian
]
¡¾ÇóÖú¡¿ÔÚÆµÂʺÍÓÅ»¯µÄͬʱ¼ÓÉÏζÈÌõ¼þÄÜÁ¿ÎªÊ²Ã´Ã»Óб仯
(8/489)
aaacjj
2009-12-03
2009-12-06 15:38:04
by
aaacjj
[
Gaussian
]
¡¾ÇóÖú¡¿ÇëÎÊÕâЩ·ûºÅ´ú±íʲôÒâ˼£¿
5
(4/825)
vallen
2009-11-25
2009-12-05 21:43:32
by
lihb734
[
Gaussian
]
¡¾ÇóÖú¡¿ÈçºÎÓÃgauss¼ÆËãKIEÖµ £¨ë®´úµÄÍ¬Î»ËØÐ§Ó¦£©
(ÆÀÔÄ+1)
(2/874)
chemlilyzhao
2009-12-05
2009-12-05 20:32:28
by
chemlilyzhao
[
Gaussian
]
¡¾ÌÖÂÛ¡¿ÆµÂʼÆËãÊÕÁ²±ê×¼£¡£¡£¡£¡
(ÆÀÔÄ+1)
(8/1161)
hzfish
2009-12-04
2009-12-05 19:31:45
by
niuniuzi41
[
Gamess/
]
¡¾×ÊÔ´¡¿Gamess×ö¹ý¶É̬
(0/241)
lb1586551
2009-12-05
2009-12-05 15:04:46
by
lb1586551
[
Gaussian
]
[¹ØÌù]
¡¾ÌÖÂÛ¡¿²»Í¬Ëã·¨µÃµ½µÄ½á¹¹ÄÜÁ¿¾ù²»Í¬£¬Á¿×Ó»¯Ñ§¼ÆËãµÄ׼ȷÐÔÈçºÎÅжÏ
(ÆÀÔÄ+1)
(8/605)
Jldbaobei
2009-12-05
2009-12-05 13:26:20
by
Jldbaobei
[
Gaussian
]
¡¾ÇóÖú¡¿ÇëÎÊÅжϲ»¶Ô³Æ·Ö×ÓµÄelectronic state
(4/433)
kaluoyi2008
2009-11-26
2009-12-05 10:34:45
by
major016
[
Gaussian
]
¡¾ÇóÖú¡¿¡¾ÇóÖú¡¿ÇóÕâÁ½±¾µç×ӽṹµÄÊé
(
1
2
)
(10/1038)
loovfnd
2009-07-15
2009-12-05 01:05:50
by
Áõ½¨±¦
[
°æÎñ
]
¡¾ÆäËû¡¿×î½üÁ¿»¯°æÓн±»î¶¯Á¬Ðø³ö»÷£¬´ó¼Ò»ØÌû¾ÍÓнð±ÒÄ㬺ðºð£¡
(3/190)
yjcmwgk
2009-12-04
2009-12-04 20:21:03
by
yjcmwgk
[
Gaussian
]
¡¾ÇóÖú¡¿ÈçºÎÓùý¶É̬ÀíÂÛ¼ÆË㻯ѧ·´Ó¦ËÙÂÊ
(7/1389)
Jldbaobei
2009-07-14
2009-12-04 19:04:35
by
yytsnake
[
Gaussian
]
¡¾ÇóÖú¡¿¼¤·¢Ì¬³öÏÖ¸º¼¤·¢ÄÜ
(3/545)
javy
2009-12-04
2009-12-04 15:36:31
by
javy
[
Gaussian
]
¡¾ÇóÖú¡¿¹ØÓÚgaussian½á¹¹µÄ²éÕÒ
(
1
2
)
(11/621)
zhanping
2009-11-30
2009-12-04 14:57:53
by
zhanping
[
Gaussian
]
¡¾ÇóÖú¡¿Çë½ÌÏ·Ö×Ó¹ìµÀ³É·ÖµÄ·ÖÎö½á¹û
1
(4/712)
xiaogang06
2009-12-01
2009-12-04 13:09:49
by
yjcmwgk
[
Molpro/
]
¡¾ÌÖÂÛ¡¿ÔõÑùÔÚmolproÖмӼüº¯Êý
20
(0/192)
hannana516
2009-12-04
2009-12-04 11:13:45
by
hannana516
[
Gaussian
]
¡¾ÌÖÂÛ¡¿¸ß˹һ¾äÃûÑÔ£¬´ó¼ÒÒ»ÆðÀí½âÏ£º£©
(5/713)
csfn
2009-12-01
2009-12-04 10:46:57
by
lwei7336
[
Gaussian
]
¡¾ÇóÖú¡¿ÊäÈëÇóÖú
(2/402)
gaohe25
2009-12-03
2009-12-04 10:23:46
by
gaohe25
[
ÆäËû
]
¡¾ÇóÖú¡¿¾²µçÊÆÍ¼ÓÃʲôÈí¼þ£¿
(2/422)
xiayunju9195
2009-12-03
2009-12-04 09:29:31
by
zhou2009
[
Gaussian
]
¡¾ÇóÖú¡¿ÇëÎÊÀë×Ó»¯ºÏÎïµÄ¼ÆËãÎÊÌâ
(ÆÀÔÄ+1)
(5/340)
linquham
2009-12-03
2009-12-04 00:20:08
by
linquham
[
Gaussian
]
¡¾ÇóÖú¡¿¸ß˹°²×°ÇóÖú
(5/716)
yjjiang
2009-12-01
2009-12-03 23:40:29
by
liujodan
[
Á¿»¯Í¼ÐÎ
]
¡¾ÇóÖú¡¿ÓÃGaussian¼ÆËãµÄ¹ý¶É̬ÓÃGaussView´ò¿ªºóûÓÐÕñ¶¯ÏÔʾ
(6/881)
yhl213
2009-11-29
2009-12-03 22:49:27
by
hzfish
[
Á¿»¯ÐÂÊÖ
]
¡¾ÇóÖú¡¿±È½Ïàç·Ô¼°ÆäÑÜÉúÎïµç¸ºÐÔ
12
(1/241)
sydxbs007
2009-12-03
2009-12-03 22:23:50
by
ZDBWHZ
[
Gaussian
]
¡¾ÇóÖú¡¿casscf/cc-pvqz·½·¨½øÐÐCO2µÄSP¼ÆËãÖеÄÎÊÌâ
(6/896)
powerful77
2009-10-20
2009-12-03 20:39:59
by
½ÌʦÁõ810
[
Gaussian
]
¡¾ÇóÖú¡¿Ñ°ÇóICSD(²»ºÃÒâ˼£¬×Ô¼ºÌ«ÀÁ£¬ÒÑËѵ½£¡)
(2/160)
zhanping
2009-12-03
2009-12-03 18:59:57
by
zhanping
[
ÆäËû
]
¡¾ÇóÖú¡¿ÈçºÎÀûÓÃ.datÎļþ»ÄÜ´øÍ¼
(3/633)
¼Ö¼Ö
2009-10-25
2009-12-03 11:30:09
by
weixp2008
[
Á¿»¯ÐÂÊÖ
]
¡¾ÇóÖú¡¿¹ØÓÚ¸ß˹¼ÆËãºË´ÅNMRºó£¬Êä³öNMRÊý¾ÝÎÊÌâ
(0/411)
liujodan
2009-12-03
2009-12-03 10:03:19
by
liujodan
[
Gaussian
]
¡¾ÇóÖú¡¿²ÉÓøß˹¼ÆËãµÄ·Ö×Ó¾²µçÊÆÄÜ·ñÕæÊµµÄ·´Ó³»¯ºÏÎïÓëÉúÎïÌåµÄÏ໥×÷Óã¿
(ÆÀÔÄ+1)
(5/894)
lifei_dut
2009-12-02
2009-12-03 08:48:31
by
lifei_dut
[
Á¿»¯ÐÂÊÖ
]
¡¾ÇóÖú¡¿LinuxϼÆËãGaussian03
(5/625)
liujodan
2009-12-02
2009-12-02 21:10:12
by
liujodan
[
Gaussian
]
¡¾ÇóÖú¡¿ÓÅ»¯Ê±µÄÊÕÁ²ÎÊÌâ
(6/529)
yanmingsun18
2009-11-28
2009-12-02 17:04:33
by
liujodan
[
Á¿»¯Í¼ÐÎ
]
¡¾ÌÖÂÛ¡¿µç×ÓÃܶÈͼÔõô·ÖÎö
(3/1045)
chuchu6816
2009-11-14
2009-12-02 15:25:53
by
zhou2009
[
Gamess/
]
¡¾×ªÔØ¡¿GAMESS(US)±àÒë·½·¨
(ÆÀÔÄ+2)
(2/740)
ÒøµÑÊéÉú
2009-11-27
2009-12-02 14:51:47
by
wfgwfgwfg
[
Á¿»¯Í¼ÐÎ
]
¡¾ÇóÖú¡¿gview ÈçºÎ¿´homo¼°lomo¹ìµÀ
(2/715)
qhy12
2009-12-01
2009-12-02 13:05:13
by
qhy12
[
Gamess/
]
¡¾ÇóÖú¡¿´Å¾Ø¼ÆËã
4
(0/347)
weixp2008
2009-12-02
2009-12-02 01:18:53
by
weixp2008
[
Gaussian
]
¡¾ÇóÖú¡¿ump2¼ÆË㳬¼«»¯ÂÊ
(
1
2
)
(11/747)
8tao7
2009-11-26
2009-12-01 22:13:18
by
yjcmwgk
[
Á¿»¯Í¼ÐÎ
]
¡¾ÇóÖú¡¿ÈçºÎ×öÁ¢ÌåʸÁ¿Í¼
14
(3/405)
mengsk
2009-11-30
2009-12-01 20:27:42
by
jjf_sxnu
[
Á¿»¯ÐÂÊÖ
]
¡¾»î¶¯¡¿GaussianµÄFAQ´ð°¸Õ÷¼¯¿ªÊ¼À²£¬»Ø´ðÕß¾ùÓнð±ÒÄã¡
(
1
2
3
4
5
6
..
7
)
(63/3928)
yjcmwgk
2009-09-23
2009-12-01 18:38:59
by
liuzhengjun0427
¡¾ÇóÖú¡¿GuassView
(ÆÀÔÄ+1)
(1/284)
shontao
2009-12-01
2009-12-01 17:41:52
by
zxyan
[
Gaussian
]
¡¾ÇóÖú¡¿Gaussian09ÔËÐÐÎÊÌâ(Òѽâ¾ö)
(
1
2
3
)
(25/1997)
Jasminer
2009-09-06
2009-12-01 17:31:41
by
digilab
[
Gaussian
]
¡¾ÇóÖú¡¿¼ÆËãµ¥µãÄܳö´í
(4/734)
yyx19840628
2009-12-01
2009-12-01 16:59:13
by
yyx19840628
[
Gaussian
]
¡¾ÇóÖú¡¿ÈçºÎʹÓÃUB3LYP·½·¨ÓÅ»¯µÚ¶þ¼¤·¢Ì¬
(7/1043)
lixiaona158
2009-11-17
2009-12-01 16:13:35
by
mickey381
[
Gaussian
]
¡¾ÇóÖú¡¿ÔõÑù¸Ä±äÓ°ÏìÈܼÁ»¯ÄܵÄALPHA²ÎÊýÄØ£¿
5
(0/242)
kgwang112
2009-12-01
2009-12-01 15:18:12
by
kgwang112
[
Gaussian
]
¡¾ÇóÖú¡¿gaussian¼ÆËãCH3NH2µÄÖÊ×Ó»¯
(4/648)
javacfish
2009-11-30
2009-12-01 14:01:15
by
yjcmwgk
[
Gaussian
]
¡¾ÌÖÂÛ¡¿Ð鯵µÄÎÊÌâ
(9/993)
gaussian08
2009-11-28
2009-12-01 13:40:39
by
zhangmt
[
ÆäËû
]
¡¾ÇóÖú¡¿¼ÆËã±äκ˴ţ¬ÄÜ·ñµÃ³ö·´Ó¦ËÙÂʳ£Êý
9
(1/368)
y071636
2009-11-30
2009-12-01 10:35:06
by
gaochao85
[
Gaussian
]
[ר¼Ò]
¡¾ÇóÖú¡¿ÎªÊ²Ã´ÎÒµÄCIS×ÜÊÇ804³ö´í¡£¡£
(5/398)
jiewei
2009-11-03
2009-12-01 09:08:08
by
zhangmt
[
Gaussian
]
¡¾Ô´´¡¿¸ÅÄîÃܶȷºº¯ÀíÂÛÔÚÔ¤²â·Ö×Ó·´Ó¦»îÐÔÖеÄÓ¦ÓÃ
(10/1114)
ZDBWHZ
2009-10-31
2009-11-30 22:35:39
by
yzcluster
[
Gaussian
]
¡¾ÇóÖú¡¿ÇóÎÊGaussian freq Ïû³ýÐ鯵
(9/1300)
taliayoung
2009-11-20
2009-11-30 22:24:22
by
superfan
[
Gaussian
]
¡¾ÇóÖú¡¿Gaussian Åú´¦Àí£¿
(6/1180)
zhanggao
2009-11-25
2009-11-30 22:12:01
by
superfan
[
Gaussian
]
¡¾ÇóÖú¡¿¹ØÓÚË㼤·¢Ì¬µÄ
4
(4/573)
caozf
2009-11-11
2009-11-30 21:40:04
by
yjcmwgk
[
Gaussian
]
¡¾ÇóÖú¡¿gaussian 03ÈçºÎ¼ÆËã·¢Éä¹âÆ×£¬ÃüÁîÈçºÎ±àд
(
1
2
)
(17/2619)
bookworm11
2009-11-29
2009-11-30 20:49:01
by
yongleli
[
ADF/Dal
]
¡¾ÇóÖú¡¿·Ö×ÓÄ£Äâ¼ÆËãAg,Pb,CuµÈÖØ½ðÊôÔ×Ó¸ÃÓÃʲô»ú×é°¡
(
1
2
)
(12/688)
nanjinger
2009-09-30
2009-11-30 19:42:35
by
¾ÅÏɾÓÊ¿
[
NBO/AIM
]
¡¾ÇóÖú¡¿NBO¼ÆË㣬ÕâÊÇʲô´íÎó
(2/288)
beckhansun
2009-10-24
2009-11-30 17:10:05
by
yjcmwgk
[
Gaussian
]
¡¾ÇóÖú¡¿g09ÖÐÁ¬Ðø¼ÆËãµÄÃüÁîÐÐÈçºÎд£¿
(8/1425)
xtdut
2009-11-29
2009-11-30 16:38:12
by
yjcmwgk
[
Gaussian
]
¡¾ÇóÖú¡¿Ö÷×åÔªËØÒ»°ãÓÃʲô´¦Àí
(ÆÀÔÄ+1)
(3/305)
3867826
2009-11-30
2009-11-30 15:47:29
by
yjcmwgk
[
Gaussian
]
[ר¼Ò]
¡¾ÇóÖú¡¿ÖؽðÎÊÒ»¸ö804³ö´íµÄÎÊÌâ
(7/781)
jiewei
2009-11-12
2009-11-30 15:45:38
by
loovfnd
5855
13/59
Ê×Ò³
ÉÏÒ»Ò³
11
12
13
14
15
16
ÏÂÒ»Ò³
Ïà¹Ø°æ¿éÌø×ª
µÚÒ»ÐÔÔÀí
Á¿×Ó»¯Ñ§
¼ÆËãÄ£Äâ
·Ö×ÓÄ£Äâ
·ÂտģÄâ
³ÌÐòÓïÑÔ
²é¿´
×îºó·¢±í
·¢Ìùʱ¼ä
°´½µÐòÅÅÁÐ
°´ÉýÐòÅÅÁÐ