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Keyword [The first principles]
Result: 101 - 119 | Page: 6 of 6
101.
The First-principles Computations Of Thermoelectric Materials SnSe And Half-heusler Alloy NbFeSb
102.
The First-principles Investigations Of Lattice Defects And Electronic Properties In Low-Dimensional Functional Materials
103.
Design And Property Studies On Novel Twodimensional Transition Metal Compound For Anode Materials
104.
Nanodevices Design Based On Boron And Phosphorus And Their Electron Transport Properties
105.
First Principles Study On The Interaction Between Surface Modification Of Graphyne And Gas Molecules
106.
First Principles Study On Hydrogen Storage Performance Of Transition Atom Doping 2D H-BN Nano Materials
107.
Study On The First Principles Of The Interlayer Interaction Of Two-dimensional Perovskites
108.
The First-principles Investigation About The Birefringence And SHG Response In Phosphates
109.
High-temperature Wettability And Interfacial Reaction Mechanism Between Silver And Ti
3
AC
2
110.
Theoretical Studies On The Electronic Structure And Properties Of MX(M=Ga,In,X=S,Se,Te)Nanoribbons
111.
Design And Physical Properties Of New Silicon And Si-Ge Alloy Materials
112.
The First Principles Study On The Alloying Effect Of Mo And Re In Tungsten And The Precipitation Mechanism Of M(W,Hf)-X(C,O,H) Compounds
113.
Study On The Regulation Of Photocatalytic Performance Of Monolayer MoS
2
Based On The First-principles
114.
Effect Of Co-doped Rutile TiO
2
Surface On Optical Gas Sensing Characteristics Of CO Gas
115.
Study On The Tri-doped Lithium Niobate Crystals By The First Principles
116.
Theoretical Study Of Intrinsic Defects And Oxygen-vacancy Distribution In In
2
O
3
117.
A Study On The Thermal Transport Properties Of SnTe Using Deep Neural Networks Learning
118.
Research On The Structure Prediction And Properties Of Novel Diamond-like Superhard Carbons
119.
The First Principles Calculation Of NO Catalytic Reduction On 3d Transition Metal-doped Graphene
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