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Keyword [density functional]
Result: 121 - 140 | Page: 7 of 10
121.
Preparation Of Codoped SrTiO
3
: Pr
3+
Materials With Sol-gel Method And Study Of Their Luminescent Mechanism
122.
Investigations On Magnetic Properties Of Ni-doped SnO
2
By First-principles Calculations
123.
Study On D~0 Ferromagnetism In ZnO
124.
Research On The Structure And Electronic Properties And X-ray Absorption Near Edge Structure Of Gold Clusters
125.
The Stability And Magnetic Moments Of Bi_mCo_n Clusters: A Study Based On Density Function Theory
126.
Electronic Structure And Magnetic Properties Of Half-Heusler Alloys CoMn
1-x
Nb
x
Sb: First-principles Study
127.
First-principles Study Of Ground-state Structures And Electronic Properties Of Pb_nS(n=1-13) And Si_mSb (m=1-14) Clusters
128.
First-principles Study Of Mg, H Doped ZnO
129.
First-Principles Study Of The Adsorption Of Ag Atoms And Water Molecules On Silica Clusters
130.
First Principle Study Of (MgO)
n
, (BeO)
n
And Ge
6
Li
6
Clusters
131.
Structural And Nonlinear Optical Properties Of Au
n-m
X
m
(X=Ag,Cu) Clusters
132.
Density-Functional Investigations On Small M_nC~±(M: Fe, Co, Ni, Cu; N=1-5) Clusters
133.
The Theoretical Study Of Phonon And Thermodynamics For Vanadium And Vanadium Hydride
134.
First-Principles Study Of Electronic Structure And Thermoelectric Power Of Na
x
CoO
2
System
135.
Molecular Dynamic Calculation On The Reaction Of Several Radical
136.
Structural, Electronic And Magnetic Properties Of Co
n-x
Mn
x
(n=0-9, X=0-9) Clusters For Density Functional Calculations
137.
First-principles Study On Electronic Transport In Metal/Organic Molecule/Metal Junctions
138.
First-principles Study On Magnetic Properties Of Defects In BN
139.
Calculation Of The Molecular Structure And Electronic Properties Of Conductive Polymer PEDOT/PSS Based On First Principles
140.
First-Principles Study Of Adsorption Properties On Doped Aluminium Oxygen Clusters
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