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Wiley电子期刊(94)	SpringerLink电子期刊(3853)	GSW全文库(29)	ACS电子期刊(5066)
Springer电子图书(2)	NATURE电子期刊(43)	Elsevier电子期刊(57583)

在“Elsevier电子期刊”中，命中：57,583条，耗时：0.0549701 秒

在所有数据库中总计命中：66,670条

1.Magnetic mesoporous nanospheres anchored with LyP-1 as an efficient pancreatic cancer probe

作者：Yongjian Jiang^a ; ¹ ; Shaojun Liu^a ; ¹ ; Yu Zhang^b ; ¹ ; Hengchao Li^a ; Hang He^a ; Juntao Dai^a ; Tao Jiang^c ; ^{laijiangtaotao@163.com} ; Weihang Ji^d ; Daoying Geng^a ; Ahmed A. Elzatahry^e ; Abdulaziz Alghamdi^f ; Deliang Fu^a ; ^{surgeonfu@163.com} ; Yonghui Deng^b ; ^g ; ^{yhdeng@fudan.edu.cn} ; Dongyuan Zhao^b

关键词：Pancreatic cancer ; Molecular imaging ; Magnetic resonance imaging ; Superparamagnetic nanospheres ; LyP-1

刊名：Biomaterials

出版年：2017

2.SnO₂/polypyrrole hollow spheres with improved cycle stability as lithium-ion battery anodes

作者：Jujun Yuan^a ; ^b ; ^{yuanjvjun@aliyun.com" class="auth_mail" title="E-mail the corresponding author} ; Chunhui Chen^b ; Yong Hao^b ; Xianke Zhang^a ; ^b ; Bo Zou^c ; Richa Agrawal^b ; Chunlei Wang^b ; ^{Wangc@fiu.edu" class="auth_mail" title="E-mail the corresponding author} ; Huajun Yu^a ; Xiurong Zhu^a ; Yi Yu^a ; Zuzhou Xiong^a ; Ying Luo^a ; Haixia Li^a ; Yingmao Xie^a

关键词：Lithium ion battery ; Anode ; SnO2/polypyrrole hollow spheres ; Wet-chemical

刊名：Journal of Alloys and Compounds

出版年：2017

3.Synthesis of Cu_0.95V₂O₅/polypyrrole core/sheath nanobelts and its electrochemical property

作者：Shaoyan Zhang^a ; ^{zsyedu@hotmail.com} ; Weirong Han^a ; Yongfang Chang^a ; Yan Sun^b ; Chunsheng Li^b

关键词：Copper vanadates ; Polypyrrole ; Lithium-ion battery ; Nanocomposites ; Functional

刊名：Chemical Physics Letters

出版年：2017

4.Dynamic ¹H-NMR study of unusually high barrier to rotation about the partial CN double bond in N,N-dimethyl carbamoyl 5-aryloxytetrazoles

作者：Fahimeh Movahedifar^a ; Ali Reza Modarresi-Alam^a ; ^{modaresi@chem.usb.ac.ir} ; Erich Kleinpeter^b ; Uwe Schilde^b

关键词：Dynamic 1H-NMR ; Carbamoyl tetrazoles ; Barrier to rotation about CN bond ; π-Stacking ; B3LYP/6-311++G**

刊名：Journal of Molecular Structure

出版年：2017

5.On the spectroscopic analyses of 3-Hydroxy-1-Phenyl-Pyridazin-6(2H)one (HPHP): A comparative experimental and computational study

作者：M.A.M. El-Mansy^a ; ^{mohamed_mansy878@yahoo.com} ; M.S. El-Bana^b ; S.S. Fouad^b

关键词：DFT/B3LYP ; HOMO-LUMO energy gap ; DOS ; NLO ; MEP

刊名：Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy

出版年：2017

6.Infrared spectral evidence and DFT calculations of hydrogen-bonding and molecular structures of acetogenins

作者：Sabrina Afonso^a ; Fabiano B. Silva^a ; Arnaldo F. Silva^b ; Ieda S. Scarminio^a ; ^ieda@uel.br ; Roy E. Bruns^b ; ^{bruns@iqm.unicamp.br}

关键词：Acetogenins ; Hydrogen bonding ; Infrared intensities ; Chemometrics ; B3LYP density functional calculation

刊名：Journal of Molecular Structure

出版年：2017

7.Synthesis, characterization and computational studies of a novel thieno[2,3-b]thiophene derivative

作者：Yahia N. Mabkhot^a ; ^{yahia@ksu.edu.sa} ; Assem Barakat^a ; ^c ; ^{ambarakat@ksu.edu.sa} ; Saied M. Soliman^b ; ^c ; ^{saied1soliman@yahoo.com} ; Tamer T. El-Idreesy^d ; ^e ; ^{tamertawhid@yahoo.com} ; Hazem A. Ghabbour^f ; ^g ; ^{ghabbourh@yahoo.com} ; Salim S. Al-Showiman^a

关键词：Thieno[2 ; 3-b]thiophene ; Enaminone ; DFT calculations ; B3LYP/6-31G(d ; p) basis set

刊名：Journal of Molecular Structure

出版年：2017

8.A quantum chemical study of molecular properties and QSPR modeling of oximes, amidoximes and hydroxamic acids with nucleophilic activity against toxic organophosphorus agents

作者：Edilson B. Alencar Filho^a ; ^{edilson.beserra@univasf.edu.br} ; Aline A. Santos^a ; Boaz G. Oliveira^b

关键词：α-nucleophiles ; Organophosphorus poisoning ; Intramolecular hydrogen bond ; B3LYP ; QTAIM ; QSPR

刊名：Journal of Molecular Structure

出版年：2017

9.DFT evidence of unforeseen bending in linearly fused polycyclic rings of hexasilabenzenoids

作者：Aayush D. Gupta ; Jyotsna S. Arora ; ^{josharora@gmail.com}

关键词：Hexasilabenzene ; Aromatic ; B3LYP ; Reorganizational energy ; Optoelectronics

刊名：Computational and Theoretical Chemistry

出版年：2017

10.Polypyrrole/TiO₂ composites for the application of photocatalysis

作者：Habib Ullah ; ^{Hu203@exeter.ac.uk}Author Vitae ; Asif Ali Tahir ; ^{A.Tahir@exeter.ac.uk}Author Vitae ; Tapas K. MallickAuthor Vitae

关键词：Band gap engineering ; DFT ; Molecular interaction ; Photocatalysis ; Redox potential

刊名：Sensors and Actuators B: Chemical

出版年：2017

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