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CNKI学位论文(69)
知网期刊论文(9)
在“
ACS电子期刊
”中,
命中:
65
条,耗时:小于0.01 秒
在所有数据库中总计命中:
78
条
1.
Theoretical Studies on Ethanol Dissociation on Iron Nanoparticles in the Early Stage of SWCNT Growth
作者:
Ying WangMenggai Jiao
;
Zhijian Wu
;
Stephan
Irle
刊名:Journal of Physical Chemistry C
出版年:2017
2.
Understanding of the Off–On Response Mechanism in Caged Fluorophores Based on Quantum and Statistical Mechanics
作者:
Kosuke Usui
;
Stephan
Irle
;
Daisuke Yokogawa
刊名:Journal of Physical Chemistry B
出版年:2016
3.
Spanning the “Parameter Space” of Chemical Vapor Deposition Graphene Growth with Quantum Chemical Simulations
作者:
Alister J. Page
;
Izaac Mitchell
;
Hai-Bei Li
;
Ying Wang
;
Meng-gai Jiao
;
Stephan
Irle
;
Keiji Morokuma
刊名:Journal of Physical Chemistry C
出版年:2016
4.
Self-Consistent Optimization of Excited States within Density-Functional Tight-Binding
作者:
Tim Kowalczyk
;
Khoa Le
;
Stephan
Irle
刊名:Journal of Chemical Theory and Computation
出版年:2016
5.
Automatized Parameterization of DFTB Using Particle Swarm Optimization
作者:
Chien-Pin Chou
;
Yoshifumi Nishimura
;
Chin-Chai Fan
;
Grzegorz Mazur
;
Stephan
Irle
;
Henryk A. Witek
刊名:Journal of Chemical Theory and Computation
出版年:2016
6.
Chiral-Selective Carbon Nanotube Etching with Ammonia: A Quantum Chemical Investigation
作者:
Clothilde A. Eveleens
;
Yuh Hijikata
;
Stephan
Irle
;
Alister J. Page
刊名:Journal of Physical Chemistry C
出版年:2016
7.
Nearly Exclusive Growth of Small Diameter Semiconducting Single-Wall Carbon Nanotubes from Organic Chemistry Synthetic End-Cap Molecules
作者:
Bilu Liu
;
Jia Liu
;
Hai-Bei Li
;
Radha Bhola
;
Edward A. Jackson
;
Lawrence T. Scott
;
Alister Page
;
Stephan
Irle
;
Keiji Morokuma
;
Chongwu Zhou
刊名:Nano Letters
出版年:2015
8.
Fabrication and Optical Probing of Highly Extended, Ultrathin Graphene Nanoribbons in Carbon Nanotubes
作者:
Hong En Lim
;
Yasumitsu Miyata
;
Miho Fujihara
;
Susumu Okada
;
Zheng Liu
;
Arifin
;
Kayoko Sato
;
Haruka Omachi
;
Ryo Kitaura
;
Stephan
Irle
;
Kazu Suenaga
;
Hisanori Shinohara
刊名:ACS Nano
出版年:2015
9.
Understanding the On–Off Switching Mechanism in Cationic Tetravalent Group-V-Based Fluoride Molecular Sensors Using Orbital Analysis
作者:
Kosuke Usui
;
Mikinori Ando
;
Daisuke Yokogawa
;
Stephan
Irle
刊名:Journal of Physical Chemistry A
出版年:2015
10.
Creation of Superheterojunction Polymers via Direct Polycondensation: Segregated and Bicontinuous Donor鈥揂cceptor 蟺-Columnar Arrays in Covalent Organic Frameworks for Long-Lived Charge Separation
作者:
Shangbin Jin
;
Mustafa Supur
;
Matthew Addicoat
;
Ko Furukawa
;
Long Chen
;
Toshikazu Nakamura
;
Shunichi Fukuzumi
;
Stephan
Irle
;
Donglin Jiang
刊名:Journal of the American Chemical Society
出版年:2015
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