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分类 共搜索到 57 个相关话题(最多显示前5000个) 作者 最后发表
科研资料 CRC-电子书-Metallic Systems:A Quantum Chemist's Perspective
The.chemistry.of.metals.is.rich.and.diverse.It.is....containing.molecules.using.first.principles.(or.semiempirical).methods.From.the.perspective.of.the.chemist,.we.are.more....
 2008100266 2017-10-26 04:39
文献求助 求文献一篇
MechanisminBlackPhosphorusfromFirst-principlesSimulationinfo'.2.'][info3]ChemistryLettersinfo'.3.'][info4]2014info'.4.'][info5]https://doi.org/10.1246/cl.140741...
 haoze 2017-10-24 02:35
文献求助 求论文一篇
Yaninfo'.1.'][info2]TowardsBondSelectiveChemistryfromFirstPrinciples:MethaneonMetalSurfacesinfo'.2.'][info3]Phys.Rev.Lett.112,046101–Published28January2014...
 wjwang123 2017-07-04 02:57
绿色求助(高悬赏) nature chemistry文献一篇
accessoptionsNatureChemistry|ArticlePrintShare/bookmarkAccuratefirst-principlesstructuresandenergiesofdiverselybondedsystemsfromanefficientdensityfunctional...
 linggang87 2017-05-24 08:53
绿色求助(高悬赏) 求文献一篇
fromfirst-principlescalculationsinfo'.2.'][info3]JournalofPhysicsandChemistryofSolidsinfo'.3.'][info4]2015info'.4.'][info5]Volume86,Pages177–185info'.5.']...
 sky_bule01 2017-04-19 02:14
招聘信息布告栏 南京某药企急招药物化学总监一名
3,Actasaninternalexpertfromtheperspectiveofmedicinalchemistrytoevaluatethenovelty,...Selectandleadfirst-in-classdrugdiscoveryprogramatSimcere.4，Utilize...
 幺之若曦 2017-04-12 07:00
文献求助完结子版 Construction of 3D V2O5/hydrogenated-WO3 nanotrees on ...
journalhysicalChemistryChemicalPhysicsinfo'.3.'][info4]Thearticlewasreceivedon20Mar2014,...(denotedasH-WO3).First-principlescalculationbasedontheexperiments...
 娜坦然的追求 2017-04-07 01:23
有机资源 分享一本2015年的书籍Organic Chemistry Concepts
ofOrganicChemistry,thebookiswrittenandorganizedforreaderswhosefirstlanguageisnotEnglish....theconceptsandlanguageoforganicchemistry,theycanbuildfromthat...
 Mr_hua 2017-02-27 11:38
文献求助 Understanding the electrochemical properties of A2MSiO4(A=Li...
andtheNadopingeffectonLi2MSiO4fromfirst-principlescalculationsinfo'.2.'][info3]JournalofMaterialsChemistryAinfo'.3.'][info4]2016info'.4.'][info5]4(44),17455...
 tb029120_11 2017-02-17 08:03
文献求助 qiuzhu
K4Fe3F12fromaFirstPrinciplesStudyinfo'.2.'][info3]ChemistrySelectinfo'.3.'][info4]2017info'.4.'][info5]Volume2,Issue2，Pages714–719info'.5.'][info7]...
 kksky 2017-01-21 02:03
文献求助 文献求助，有链接
equilibriaandelectronicstructurefromfirstprinciplescalculationsinfo'.2.'][info3]PhysicalChemistryChemicalPhysicsinfo'.3.'][info4]2012info'.4.'][info5]14,11808-...
 轻轻飘过之 2016-12-24 01:24
文献求助 first-principle investigation of the 57Femoessbauer ...
lippenspierre-emmanuelinfo'.1.'][info2]first-principlesinvestigationofthe57femoessbauerparametersofLiFePo...ofphysicalchemistryCinfo'.3.'][info4]2016info'.4.']...
 曹艺艺 2016-12-09 05:26
文献求助 as a cathode material for lithium ion batteries from first ...
cathodematerialforlithiumionbatteriesfromfirstprinciplescalculationsinfo'.2.'][info3]PhysicalChemistryChemicalPhysicsinfo'.3.'][info4]2013info'.4.'][info5]...
 mnbvzxc1 2016-12-09 01:17
科研资料 【转自Springer】Principles and applications of ESR ...
rangingfromphysicstobiology.Itaimsbothatprovidingtheprinciplesofcontinuouswaveand...fieldESRtechniquestreatedinthefirstfourchaptersarethusfollowedby...
 982693965 2016-12-01 08:28
文献求助 RSC wenxian
[info1]ZHANGL,WUJZ,JIANGSL,etal.info'.1.'][info2]Fromintermolecularinteractionsto...explosive:afirst-principlesstudyinfo'.2.'][info3][J].PhysicalChemistry...
 99556432 2016-11-29 04:18
绿色求助(高悬赏) 求文献一篇
propertiesofpotentiallysuperhardWBxpolymorphsfromfirstprinciplescalculationsinfo'.2.'][info3]MaterialsChemistryandPhysicsinfo'.3.'][info4]2016info'.4.'][info...
 sky_bule01 2016-10-29 11:55
科研资料 X射线吸收精细结构英文书籍——XAFS for everyone
chemistry,art,andarchaeology.Inaddition,fivecasestudiesfromtheliteraturedemonstratetheuseofXAFSprinciplesandanalysisinpractice.Thetextincludesderivations...
 学海浪子 2016-10-20 02:37
文献求助 有链接
typeiron-basedsuperconductorspredictedfromfirst-principlesinfo'.2.'][info3]PhysicalChemistryChemicalPhysicsinfo'.3.'][info4]Phys.Chem.Chem.Phys.,2012,14,15029-...
 wwwcwnu 2016-10-17 07:44
文献求助 Thermal desorption of molecular oxygen from SnO2(110)surface...
surface:Insightsfromfirst-principlescalculationsinfo'.2.'][info3]JOURNALOFPHYSICSANDCHEMISTRYOFSOLIDSinfo'.3.'][info4]2016info'.4.'][info5]卷:89页:15-22info'...
 至秦helen 2016-09-12 03:57
绿色求助(高悬赏) 2016年Materials Chemistry and Physics文献
mechanicalandopticalpropertiesofpotentiallysuperhardWBxpolymorphsfromfirstprinciplescalculationsinfo'.2.'][info3]MaterialsChemistryandPhysicsinfo'.3.'][info4...
 meimeidyh 2016-09-07 01:29
文献求助 文献求助
equilibriaandelectronicstructurefromfirstprinciplescalculationsinfo'.2.'][info3]PhysicalChemistryChemicalPhysicsinfo'.3.'][info4]2012info'.4.'][info5]11808-...
 轻轻飘过之 2016-08-25 07:20
文献求助 求nature chem论文一篇
MichaelL.Klein&JohnP.Perdewinfo'.1.'][info2]Accuratefirst-principlesstructuresandenergiesofdiverselybondedsystemsfromanefficientdensityfunctionalinfo'.2.']...
 fansw1129 2016-08-18 09:06
外语学习 很好的科普书 2016版 A World From Dust:How the Periodic Table...
principlesofevolutioninordertocreateanenvironmentinwhichlifeasweknowitcould...allowingforlifetoemergefromtheworld'sfirstrocks.Hetracesthehistory...
 zhaowp 2016-08-06 01:30
文献求助 qiuzhu
Yang,Rinfo'.1.'][info3]JOURNALOFPHYSICALCHEMISTRYCinfo...
 何开宙 2016-06-26 01:09
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