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在“
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”中,
命中:
31,968
条,耗时:0.1569244 秒
在所有数据库中总计命中:
44,960
条
1.
First-principles investigations of structural,
m
echanical,
electronic
and optical
properties
of U
3
Si
2
-type AlSc
2
Si
2
under high pressure
作者:
Xu-dong ZHANG
a
;
sutxyz@163.co
m
;
Feng WANG
b
;
Wei JIANG
a
;
b
关键词:
U3Si2-type AlSc2Si2
;
m
echanical
properties
;
electronic
structure
;
optical
properties
;
first-principles calculations
刊名:Transactions of Nonferrous
M
etals Society of China
出版年:2017
2.
DFT based FP-LAPW investigation of structural,
electronic
and optical
properties
of Sr
x
Pb
1−
x
S, Sr
x
Pb
1−
x
Se and Sr
x
Pb
1−
x
Te ternary alloys
作者:
Surya Chattopadhyaya
a
;
surya_ju@yahoo.co
m
;
Rahul Bhattacharjee
a
;
b
关键词:
Se
m
iconductor ternary alloys
;
FP-LAPW
;
TB-
m
BJ
;
Structural
properties
;
Electronic
properties
;
Optical
properties
刊名:Journal of Alloys and Co
m
pounds
出版年:2017
3.
Electronic
theoretical study of the influences of O adsorption on the
electronic
structure and optical
properties
of graphene
作者:
Zhou Shuang
;
Liu Guili
;
LGL63@sina.cn
;
Fan Dazhi
关键词:
Graphene
;
Coverage
;
Electronic
structure
;
Optical
properties
;
Adsorption
;
Density functional theory
刊名:Physica B: Condensed
M
atter
出版年:2017
4.
Electronic
structure and
properties
of (TiZrNbCu)
1-x
Ni
x
high entropy a
m
orphous alloys
作者:
Katica Biljaković
a
;
Gy&ou
m
l
;
rgy Re
m
enyi
b
;
Ignacio A. Figueroa
c
;
Ra
m
ir Ristić
d
;
ra
m
ir.ristic@fizika.unios.hr
;
Da
m
ir Pajić
e
;
Ah
m
ed Kur&scaron
;
u
m
ović
f
;
Da
m
ir Stare&scaron
;
inić
a
;
Kre&scaron
;
o Zadro
e
;
E
m
il Babić
e
关键词:
M
etallic glasses
;
Electronic
band structure
;
Heat capacity
;
M
echanical
properties
刊名:Journal of Alloys and Co
m
pounds
出版年:2017
5.
Effect of Fe doping on the
electronic
structure, optical and electrical
properties
of ZnO co
m
pound: Ab initio insights
作者:
M
. Ha
mm
i
a
;
Y. Ziat
b
;
A. Ait Raiss
b
;
M
. Arejdal
b
;
Y. Sbai
b
;
O. El Rhazouani
b
;
A. Slassi
b
;
a.slassi@yahoo.fr
;
a.slassi22@g
m
ail.co
m
关键词:
DFT calculations
;
Electronic
structure
;
Se
m
i-classical boltz
m
ann equations
;
Electrical
properties
;
Optical
properties
刊名:Optik - International Journal for Light and Electron Optics
出版年:2017
6.
DFT investigation of structural,
electronic
and optical
properties
of pure and Er-doped ZnO:
M
odified Becke-Johnson exchange potential
作者:
E.A. Alkahtani
a
;
b
;
A.E.
M
erad
a
;
ae
m
erad@g
m
ail.co
m
" class="auth_
m
ail" title="E-
m
ail the corresponding author
;
k_
m
erad@univ-tle
m
cen.dz" class="auth_
m
ail" title="E-
m
ail the corresponding author
;
M
.R. Boufatah
a
;
A. Benos
m
an
c
关键词:
Er-doped ZnO
;
FP-LAPW
;
m
BJ potential
;
Electronic
structures
;
Optical
properties
刊名:Optik - International Journal for Light and Electron Optics
出版年:2017
7.
M
echanical
properties
and
electronic
structures of Fe-Al inter
m
etallic
作者:
YaHui Liu
;
XiaoYu Chong
;
YeHua Jiang
;
jiangyehua@k
m
ust.edu.cn
;
Rong Zhou
;
Jing Feng
;
jingfeng@k
m
ust.edu.cn
关键词:
Fe-Al inter
m
etallic
;
M
echanical
properties
;
Electronic
structures
;
Debye te
m
perature
;
First-principles calculation
刊名:Physica B: Condensed
M
atter
出版年:2017
8.
Structural, elastic and
electronic
properties
of C14-type Al
2
M
(M=Mg, Ca, Sr and Ba) Laves phases
作者:
M
a Lishi
;
Duan Yonghua
;
duanyh@k
m
ust.edu.cn
;
Li Runyue
关键词:
First-principles calculations
;
Phase stability
;
Elastic
properties
;
Anisotropy
;
Electronic
structures
刊名:Physica B: Condensed
M
atter
出版年:2017
9.
The U-Nb-Al ternary syste
m
: experi
m
ental and si
m
ulated investigations of the phase equilibria and study of the crystal structure and
electronic
properties
of the inter
m
ediate phases
作者:
Chantal
M
oussa
a
;
Alexandre Berche
a
;
M
athieu Pasturel
a
;
José
;
Barbosa
a
;
Bertrand Stepnik
b
;
Sylvie Dubois
c
;
Olivier Tougait
a
;
d
;
tougait@univ-rennes1.fr" class="auth_
m
ail" title="E-
m
ail the corresponding author
关键词:
Actinide alloys and co
m
pounds
;
Rapid-solidification
;
quenching
;
Electronic
properties
;
Heavy fer
m
ions
;
Ther
m
odyna
m
ic
m
odeling
;
X-ray diffraction
刊名:Journal of Alloys and Co
m
pounds
出版年:2017
10.
Structural,
electronic
and
m
agnetic
properties
of RE
3+
-doping in CoFe
2
O
4
: A first-principles study
作者:
Y.H. Hou
a
;
hyhhyl@163.co
m
" class="auth_
m
ail" title="E-
m
ail the corresponding author
;
Y.L. Huang
a
;
S.J. Hou
a
;
S.C.
M
a
a
;
Z.W. Liu
b
;
Y.F. Ouyang
c
关键词:
Spinel cobalt ferrite
;
First-principles calculation
;
Electronic
structure
;
M
agnetic
properties
刊名:Journal of
M
agnetis
m
and Magnetic Materials
出版年:2017
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