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热点
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论文的挂名怎么评判贡献?基金申请中,排名第一的挂名文章
biily
2026-11-01
刚刚
[
MS
]
【求助】如何把更多内存划给MS使用?
(
1
2
)
(10/900)
wfbgc
2009-03-17
2009-03-18 23:52:26
by
wfbgc
[
Vasp&Me
]
[求助]vasp 可不可以加压强?
(3/953)
emily6526
2009-03-18
2009-03-18 21:34:49
by
stractor
[
MS
]
[求助]linux本机运行DPD模块找不到beads
(0/140)
xuanxuan03
2009-03-18
2009-03-18 17:59:25
by
xuanxuan03
[
MS
]
about Dmol3
(0/144)
jun.ren
2009-03-18
2009-03-18 17:22:54
by
jun.ren
【求助】计算机配置
(
1
2
)
(10/1134)
Sylatoe
2009-03-17
2009-03-18 16:45:05
by
madonion
【求助】安装Windows Linux双系统时出现新问题
(8/982)
xttide
2008-12-24
2009-03-18 15:32:29
by
tjpm
[
MS
]
【求助】請問如何在DMol3中的計算頻率特性?淼玫浇殡姵的兀�
(0/116)
a405352000
2009-03-18
2009-03-18 12:00:00
by
a405352000
[
MS
]
【求助】MS中怎样建具有单向周期性的晶格?
(4/687)
mcy01
2009-03-17
2009-03-18 10:17:53
by
mcy01
[
MS
]
【求助】关于结构优化
(1/213)
wwj_0905
2009-03-18
2009-03-18 09:48:14
by
wwj_0905
[
MS
]
求助:远程控制提交windows下的ms的任务
(5/515)
lylemon
2009-03-16
2009-03-18 09:46:00
by
lylemon
[
MS
]
【求助】ZN掺杂在AL中时,操作步骤怎么运行?好多次都失败了
(评阅-2)
(0/123)
caoshangfei2007
2009-03-18
2009-03-18 09:43:45
by
caoshangfei2007
[
Siesta&
]
【讨论】Nanolanguage Scripter 中的设置 疑惑
(评阅+2)
(3/532)
fan0221
2009-03-17
2009-03-18 09:42:28
by
fan0221
[
MS
]
【求助】碳纳米管复合材料建模
(4/633)
yokee-jin
2009-03-16
2009-03-18 09:27:18
by
yokee-jin
[
其他
]
【求助】CPMD中emass和stepsize参数的设定
(2/234)
suny2005
2009-03-17
2009-03-18 08:41:38
by
suny2005
[
其他
]
【求助】请教达人:HOKSO和HOMO,LUKSO和LUMO的区别
(2/210)
xiaowandouer
2009-03-17
2009-03-18 08:25:45
by
xiaowandouer
【求助】关于一些结果的解释
(
1
2
)
(12/865)
wwj_0905
2009-03-17
2009-03-18 08:03:19
by
acridine
[求助]关于vasp计算的电子密度分布
(7/1683)
hadone
2009-03-03
2009-03-18 00:07:25
by
martin2
[
MS
]
求助:声子谱参数的设置
(2/234)
wenmenkui
2009-03-17
2009-03-17 22:37:12
by
wenmenkui
[讨论]如何消虚频?
(9/1090)
huangyc
2009-03-12
2009-03-17 19:07:28
by
spur
[
其他
]
【求助】租用超算账号的价格是多少
(2/355)
martinfty
2009-03-09
2009-03-17 18:20:55
by
snoopyzhao
[
MS
]
[求助】服务器不能运行
(0/117)
hxwyy2005
2009-03-17
2009-03-17 17:24:16
by
hxwyy2005
[
MS
]
[求助]MS动力学模拟的问题
(
1
2
3
)
(26/1417)
yncuiyan
2009-03-03
2009-03-17 16:49:50
by
zyj8119
【求助】MS中碳纳米管的扭转
(5/782)
ypf1449
2009-03-10
2009-03-17 16:09:25
by
mcy01
[
MS
]
求助 energy not corrected for finite basis set
(2/192)
dongdong3881
2009-03-13
2009-03-17 15:29:59
by
dongdong3881
【求助】 关于表面吸附的
(6/628)
bingxing
2009-03-04
2009-03-17 14:20:54
by
cbFeng200881
[
MS
]
求助Al6Mn 结构
(1/134)
caoshangfei2007
2009-03-16
2009-03-17 10:46:46
by
zxzj05
[
MS
]
[求助]关于NaCl的两种结构
(3/323)
sunday6392
2009-03-16
2009-03-17 10:07:17
by
sunday6392
[
Wien2k&
]
【求助】wien2k安装!
(5/2563)
Wanghui6383
2009-03-16
2009-03-17 09:58:31
by
zxzj05
[求助]Material Studio 4.4 for linux安装出错
(
1
2
)
(14/1498)
xuanxuan03
2009-03-13
2009-03-17 07:50:05
by
yhlllf
[求助] vasp中计算得到的极化率单位
(4/712)
lxjuan
2009-03-14
2009-03-17 03:14:22
by
lxjuan
[
MS
]
【求助】MS中可以检测Sp2 Sp3含量吗
(1/137)
zplmff
2009-03-16
2009-03-16 23:32:44
by
y1ding
[
Vasp&Me
]
【讨论】计算能带的K点?
(2/256)
tfh00
2009-03-16
2009-03-16 23:31:37
by
y1ding
[
其他
]
【求助】如何向论坛里特定的虫子请教问题呢?
(1/93)
fyqfyh82
2009-03-16
2009-03-16 21:00:05
by
zdhlover
[
MS
]
【求助】 castep计算中的warnning
(1/200)
bingxing
2009-03-16
2009-03-16 20:15:17
by
wuli8
【求助】晶胞模型不动了
(3/459)
小臭虫
2009-03-09
2009-03-16 19:57:32
by
puchunying
【求助】MS4.3里自带的高斯软件能用吗
(7/631)
liujie5631
2009-03-05
2009-03-16 18:02:23
by
physics206
[
MS
]
求教高手关于MS在LINUX(RED HAT)下的安装问题
(9/1300)
kugou521
2009-03-07
2009-03-16 17:57:32
by
physics206
【求助】ms for unix 安装中gateway的问题
(7/826)
hongchen973
2009-03-11
2009-03-16 17:37:58
by
physics206
[
MS
]
【求助】Dmol计算态密度
(7/1410)
hongchen973
2009-03-14
2009-03-16 16:58:12
by
xiaoboy185
[
MS
]
[求助]计算机配置
(4/501)
dingyongbo
2009-03-15
2009-03-16 14:49:54
by
守望者7981
[
MS
]
【求助】计算杂质形成能时,块材料的化学势的问题
(2/363)
idoldog
2009-03-12
2009-03-16 12:22:37
by
cbFeng200881
[
MS
]
【求助】GGA与LDA函数的区别?
(7/2621)
leijunfeng
2008-04-02
2009-03-16 10:39:38
by
leijunfeng
[
MS
]
【求助】如何购买Materials Studio材料计算软件
(
1
2
)
(14/2765)
yitahutu
2009-02-21
2009-03-16 10:30:29
by
dcbb0217
[
MS
]
【求助】帮助文件实例中discover的能量解释
(0/143)
fyqfyh82
2009-03-16
2009-03-16 09:57:51
by
fyqfyh82
[
MS
]
[求助]charge group的设置
(0/146)
Sylatoe
2009-03-16
2009-03-16 09:57:43
by
Sylatoe
[
MS
]
[求助]脱附等温线
(1/119)
zyj8119
2009-03-13
2009-03-16 09:57:14
by
Sylatoe
[
MS
]
【求助】怎么知道能带图中的states是不是unoccupied的
(0/113)
idoldog
2009-03-15
2009-03-15 23:08:38
by
idoldog
[
MS
]
【求助】Dmol3 中grd文件格式
(4/540)
jghe
2009-03-14
2009-03-15 21:13:08
by
jghe
[
其他
]
[求助]谁知道这个程序V.R. Saunders, ATMOL-SCF Program
20
(0/87)
maomao1210
2009-03-15
2009-03-15 19:54:03
by
maomao1210
[
MS
]
【求助】MS几个问题
(0/156)
守望者7981
2009-03-15
2009-03-15 18:30:59
by
守望者7981
[
Wien2k&
]
[求助]请问国内有哪个研究机构提供Wien2k的培训
(9/1002)
benzscu
2009-02-19
2009-03-15 16:21:01
by
shxincui518
[
Wien2k&
]
【讨论】各种材料计算软件比较!
(评阅+6)
(3/1121)
Wanghui6383
2009-01-01
2009-03-15 16:16:49
by
zxzj05
[
Wien2k&
]
【求助】Wien2K的最基本教程
(7/1587)
pptang
2009-02-25
2009-03-15 16:15:23
by
zxzj05
[
MS
]
求助:MS重装后文件后面没有.input, .xsd之类的,怎么回事呢?
(2/146)
duoruimi
2009-03-12
2009-03-15 12:30:53
by
duoruimi
[
MS
]
【求助】打开MS时出现问题
(0/171)
jiawdd
2009-03-15
2009-03-15 12:09:21
by
jiawdd
[
其他
]
[求助]VASP、MS、wein2k计算条件配置
(3/548)
wuli8
2009-03-14
2009-03-15 11:03:18
by
y1ding
[
MS
]
[求助]关于dmol计算的问题.
(4/601)
deadbook
2009-02-25
2009-03-14 23:39:33
by
deadbook
[
MS
]
求助用MS计算低维材料问题~~~~
(3/433)
kugou521
2009-03-14
2009-03-14 21:05:32
by
wuli8
[
MS
]
【求助】MS 结构问题
(2/187)
zwenzhi
2009-03-14
2009-03-14 19:04:53
by
zwenzhi
【求助】10金币请问关于torque的问题
8
(2/218)
coolrainbow
2009-03-04
2009-03-14 18:22:29
by
coolrainbow
【求助!!】MS安装后无法启动!!
(
1
2
)
(10/856)
kangnana
2009-03-11
2009-03-14 15:31:07
by
kangnana
[求助]VASP能带结构作图的问题
(1/532)
liumiao05
2009-03-14
2009-03-14 13:33:48
by
miracle3130
[
MS
]
[求助] 关于晶胞优化!
2
(7/1134)
zjy1818
2009-03-01
2009-03-14 12:55:04
by
zjy1818
[
MS
]
【讨论】想用MS4.4做一下有关金属整合物分子的计算
(3/311)
googo66
2009-03-12
2009-03-14 01:25:04
by
googo66
【分享】Linux作业调度系统Torque管理员手册
(1/369)
xujc1983
2009-02-24
2009-03-14 00:07:48
by
physics206
[
MS
]
【求助】有关结构优化不收敛的问题
(3/718)
daisyggg
2009-03-13
2009-03-13 22:59:05
by
daisyggg
[
MS
]
求助:如何能把电子密度分布图以文本形式的文件输出
(0/158)
378287892
2009-03-13
2009-03-13 22:20:34
by
378287892
[
QE(Pwsc
]
fqha.x
(评阅-2)
(2/152)
lidonglin556
2009-03-06
2009-03-13 21:40:32
by
lidonglin556
【求助】用CASTEP计算惨杂
(评阅+1)
(5/555)
hzy900211
2009-03-12
2009-03-13 20:11:47
by
hzy900211
[
MS
]
求助:无序二氧化硅结构
2
(0/137)
ls8396
2009-03-13
2009-03-13 19:10:15
by
ls8396
[
其他
]
【求助】vi是 ’ ‘ (单引号的两个不同方向)怎么输入?
(3/288)
cheerian
2009-03-12
2009-03-13 17:59:45
by
老虎大王
[
MS
]
[关贴]
求助:服务器和本机计算不能同时进行([color=Red]问题解决请版主封贴[/color])
(4/298)
qx08131989
2009-03-13
2009-03-13 11:45:59
by
qx08131989
【求助】再再问-在服务器中启动图形界面
(3/329)
cheapskate
2009-03-10
2009-03-13 10:49:18
by
abbott
[
MS
]
energy not corrected for finite basis set
(评阅-2)
(0/427)
dongdong3881
2009-03-13
2009-03-13 09:49:12
by
dongdong3881
[
MS
]
(求助)CASTEP计算能量
(6/985)
crante
2009-03-11
2009-03-13 09:31:33
by
crante
【求助】求一个56邮箱名和密码,每个提供者可获至少2个金币
(3/291)
呀呀
2009-03-11
2009-03-12 21:16:03
by
maybe168
[
其他
]
通知贴--~~~~科研工具和计算模拟区2009年有奖征文活动
(0/229)
fegg7502
2009-03-12
2009-03-12 20:26:00
by
fegg7502
[
MS
]
【求助】结构优化
(1/291)
小臭虫
2009-03-12
2009-03-12 18:53:05
by
crante
[
MS
]
【求助】born 有效电荷
(1/394)
wwj_0905
2009-03-12
2009-03-12 16:52:12
by
wwj_0905
【求助】关于结构优化
(5/563)
wwj_0905
2009-03-11
2009-03-12 16:51:55
by
wwj_0905
[
MS
]
【求助】关于 “溶剂相容性的分子动力学模拟”的论文
(0/134)
laoda402
2009-03-12
2009-03-12 16:44:13
by
laoda402
[
MS
]
[求助] MS 不能用
(0/132)
jghe
2009-03-12
2009-03-12 16:22:05
by
jghe
[
MS
]
【求助】如何建立Pt的(111)表面
(0/122)
asaruda
2009-03-12
2009-03-12 16:13:19
by
asaruda
[
MS
]
【求助】:这句话怎么理解?which 指代什么?
(1/124)
goodman959
2009-03-12
2009-03-12 15:40:54
by
goodman959
[
MS
]
(求助)利用那些软件可以做反应路径及各自优缺点?
(5/411)
不眠人
2009-03-10
2009-03-12 15:36:27
by
不眠人
【求助】计算聚合物分子间氢键
(9/594)
466902981
2009-03-04
2009-03-12 14:29:57
by
qasd
[
Siesta&
]
【讨论】请教个voltdrop的计算结果读取的问题
(2/149)
fan0221
2009-03-11
2009-03-12 10:24:39
by
fan0221
【求助】优化构型
(5/575)
effi903
2009-03-11
2009-03-12 09:21:18
by
acridine
[
MS
]
(求助)放出的ms4.4的lic文件在linux里不能用
(4/493)
gaussian08
2009-03-07
2009-03-11 23:56:06
by
y1ding
[
MS
]
【求助】: discover里的偶极相关函数
(6/372)
xutianjun
2009-03-11
2009-03-11 21:23:31
by
xutianjun
【求助】有关动力学计算密度的问题
(9/775)
赵浩然
2009-03-10
2009-03-11 20:53:50
by
qasd
[
MS
]
【求助】dmol3提示错误,不能运算
(0/173)
jnjnsun
2009-03-11
2009-03-11 18:31:37
by
jnjnsun
【求助】:关于MD的退火设置
(3/406)
xutianjun
2009-03-10
2009-03-11 16:16:48
by
xutianjun
【求助】形成能如何从头算???
(4/482)
wply20100
2009-01-16
2009-03-11 15:30:59
by
zrfssh
【求助】castep计算IR spectrum
(1/230)
Robin_Fu
2009-03-11
2009-03-11 15:04:58
by
zxzj05
[
MS
]
【求助】MS建模问题
(3/420)
zwenzhi
2009-03-10
2009-03-11 14:39:14
by
zwenzhi
[
MS
]
【求助】Dmol输出文件中的warning
(0/204)
hongchen973
2009-03-11
2009-03-11 14:02:57
by
hongchen973
[
MS
]
[求助]不知道是怎么回事
(3/356)
chzhmei
2009-03-11
2009-03-11 13:35:40
by
zxzj05
[
MS
]
[求助] CASTEP 掺杂
(1/400)
好好学习772
2009-03-11
2009-03-11 11:11:15
by
心宁
【求助】再问-有关服务器上安装pwscf问题
(5/752)
cheapskate
2009-03-10
2009-03-11 09:33:31
by
cheapskate
9051
61/91
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