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内部出版物
在“
Elsevier电子期刊
”中,
命中:
750
条,耗时:0.0139913 秒
1.
Decarbonylation and hydrogenation reaction of furfural on Pd/Cu(111) surface
作者:
Meng-dan QIAN
;
Ji-long XUE
;
Sheng-jie XIA
;
Zhe-ming NI
;
jchx@zjut.edu.cn
;
Jun-hui JIANG
;
Yong-yong CAO
关键词:
furfural
;
density functional theory
;
Pd/Cu(111) bimetallic surface
;
adsorption
;
decarbonylation
;
hydrogenation
刊名:Journal of Fuel Chemistry and Technology
出版年:2017
2.
Comparative study on hydrogenation of propanal on Ni(111) and Cu(111) from density functional theory
作者:
Wei An
;
weian@sues.edu.cn
;
Yong Men
;
Jinguo Wang
关键词:
Hydrogenation
;
Propanal
;
Ni(111)
;
Cu(111)
;
DFT
刊名:Applied Surface Science
出版年:2017
3.
Magnetism of coherent Co and Ni thin films on Cu(111) and Au(111) substrates: An ab initio study
作者:
Martin Zelený
;
;
zeleny@fme.vutbr.cz" class="auth_mail" title="E-mail the corresponding author
;
Ivo Dlouhý
关键词:
Thin films
;
Magnetic anisotropy
;
Ab initio calculations
;
fcc&ndash
;
hcp transformation
刊名:Journal of Magnetism and Magnetic Materials
出版年:2017
4.
Dispersion and damping of the interband π plasmon in graphene grown on Cu(111) foils
作者:
A. Politano
a
;
antonio.politano@fis.unical.it
;
I. Radović
b
;
D. Borka
b
;
Z.L. Mi&scaron
;
ković
c
;
H.K. Yu
d
;
e
;
D. Farí
;
as
f
;
g
;
h
;
G. Chiarello
a
;
gennaro.chiarello@fis.unical.it
刊名:Carbon
出版年:2017
5.
Resonant core spectroscopies of the charge transfer interactions between C
60
and the surfaces of Au(111), Ag(111), Cu(111) and Pt(111)
作者:
Andrew J. Gibson
a
;
Robert H. Temperton
a
;
Karsten Handrup
b
;
James N. O'Shea
a
;
J.Oshea@nottingham.ac.uk
关键词:
Fullerenes
;
Metal surfaces
;
Charge transfer
;
Resonant photoemission
;
Core-hole clock
;
Autoionisation
刊名:Surface Science
出版年:2017
6.
Insight into the promotion effect of pre-covered X (C, N and O) atoms on the dissociation of water on Cu(111) surface: A DFT study
作者:
Zhao Jiang
;
Tao Fang
;
taofang@mail.xjtu.edu.cn" class="auth_mail" title="E-mail the corresponding author
关键词:
DFT
;
Cu(111) surface
;
Dopd-X
;
H2O
;
Dissociation
刊名:Applied Surface Science
出版年:2016
7.
Density functional theory study of O-H and C-H bond scission of methanol catalyzed by a chemisorbed oxygen layer on Cu(111)
作者:
Jonathan Li
a
;
Guangwen Zhou
b
;
gzhou@binghamton.edu" class="auth_mail" title="E-mail the corresponding author
关键词:
Methanol oxidation
;
Cu(111)
;
Cu2O
;
Chemisorbed oxygen
;
Density-functional theory
;
Bond scission
刊名:Surface Science
出版年:2016
8.
Quantum mechanical study of CO
2
and CO hydrogenation on Cu(111) surfaces doped with Ga, Mg, and Ti
作者:
Yohaselly Santiago-Rodrí
;
guez
;
Erick Barreto-Rodrí
;
guez
;
Marí
;
a C. Curet-Arana
;
maria.curetarana@upr.edu" class="auth_mail" title="E-mail the corresponding author
关键词:
CO2/CO hydrogenation
;
Metal-doped copper surfaces
;
Density functional theory
;
Reaction mechanism
;
Synthesis of methanol formic acid
;
formaldehyde
刊名:Journal of Molecular Catalysis A: Chemical
出版年:2016
9.
Reaction pathways of furfural, furfuryl alcohol and 2-methylfuran on Cu(111) and NiCu bimetallic surfaces
作者:
Ke Xiong
a
;
Weiming Wan
b
;
Jingguang G. Chen
b
;
c
;
jgchen@columbia.edu" class="auth_mail" title="E-mail the corresponding author
关键词:
Biomass
;
Furfural
;
Hydrodeoxygenation
;
NiCu bimetallic
;
2-Methylfuran
刊名:Surface Science
出版年:2016
10.
The role of thermal excitation in the tunneling-electron-induced reaction: Dissociation of dimethyl disulfide on Cu(111)
作者:
Kenta Motobayashi
a
;
b
;
c
;
kmotobayashi@cat.hokudai.ac.jp" class="auth_mail" title="E-mail the corresponding author
;
Yousoo Kim
c
;
Michiaki Ohara
c
;
Hiromu Ueba
d
;
Maki Kawai
b
关键词:
Scanning tunneling microscopy
;
Single molecule chemistry
;
Action spectroscopy
;
Reaction mechanism
;
Surface science
刊名:Surface Science
出版年:2016
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