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分类 共搜索到 11 个相关话题(最多显示前5000个) 作者 最后发表
功能材料 electronic couplings
电子耦合是什么意思?
风潜 2020-04-22 09:47
论文投稿 计算类审稿意见
structural,energetic,andelectronicpropertiesoftheclusterswithfrom2to14atompairs.The...spin-orbitcouplingsinthecalculations,althoughforPbthismaybeanot...
18213818611 2017-02-02 12:35
文献求助 Inorg.Chem.,2011,50(24),pp 12601–12622
AtomontheElectronicandMagneticCouplingsinfo'.2.'][info3]Inorg.Chem.,2011,50(24),pp12601–12622info'.3.'][info4]Inorg.Chem.,2011,50(24),pp12601–12622info'.4.']...
hanjianwei 2016-12-08 03:46
文献求助 [求助]外文文献1篇
Packing,andElectronicCouplings.info'.2.'][info3]Adv.Mater.doi:10.1002/adma.201601282info'.3.'][info4]2016info'.4.'][info5]Adv.Mater.doi:10.1002/adma.201601282info'....
napro 2016-07-15 01:13
文献求助完结子版 求JACS期刊一篇
info'.1.'][info2]ElectronicCouplingsinOrganicMixed-ValenceCompounds:?TheContributionofPhotoelectronSpectroscopyinfo'.2.'][info3]J.Am.Chem.Soc.info'.3.'][info4...
huangda 2015-06-29 01:22
分子模拟 MS可以算两个分子之间的电子耦合(electronic couplings)能吗?
RT,现在手上有高斯和MS。想计算两个分子间的电子耦合能(electroniccouplings)。看文献上说,是分别计算了HOMO和LUMO的转移积分(chargetransferintegral);重叠积分(overlapintegral)...
fanghongxun 2014-11-14 05:29
文献求助完结子版 Site-specific electronic couplings in dyads with MLCT ... 匿名 2013-09-23 01:39
检索知识 免费的20个图谱数据库及其链接
specificdataincludingassignedchemicalshifts,J-couplings,...IRspectraforover5000compounds,massspectraforover10,000compounds,electronic/vibrationalspectraforover3000compounds,...
gruyclewee 2012-08-14 01:26
晶体 【分享】免费的20个谱图数据库
specificdataincludingassignedchemicalshifts,J-couplings,...IRspectraforover5000compounds,massspectraforover10,000compounds,electronic/vibrationalspectraforover3000compounds,...
wxknever 2010-08-03 06:02
晶体 免费的谱图数据库20个
specificdataincludingassignedchemicalshifts,J-couplings,...IRspectraforover5000compounds,massspectraforover10,000compounds,electronic/vibrationalspectraforover3000compounds,...
drg1984 2010-04-14 02:17
分析 【原创分享】还求助么:免费的谱图数据库20个(亲自测试,全部...
specificdataincludingassignedchemicalshifts,J-couplings,...IRspectraforover5000compounds,massspectraforover10,000compounds,electronic/vibrationalspectraforover3000compounds,...
kong0908 2008-10-04 05:15