first-principle calculations - Globe Thesis

Keyword [first-principle calculations] Result: 1 - 20 \| Page: 1 of 6
1.	First-principles Of Electronic Structure For Layered Perovskite-type Organic-inorganic Hybrids
2.	Low-Dimensional Semiconductor Nanomaterials And Hetero-structures:The First Principle Calculations
3.	First Principle Calculations Of The SrTiO₃ Oxygen Sensed Materials And Carbon Nanotubes
4.	Electronic Structure Of SrTiO₃-based Heterointerface: Theoretical Study
5.	First-principles Calculations Of Precipitation Phase In Al-Cu-Mg Alloys
6.	A First-Principle Study Of Stacking-Fault Energy Barriers In Metals And Alloys
7.	Investigation Of Relative Problems About Pure Iron Surface Mechanical Attrition Treatment And First-principles Calculations Of Carbon Monoxide Surface Absorption
8.	The Experimental Synthesis And Theoretical Reserch Of New Transition Metal Carbide (Re₂C,RuC And Irc)
9.	Study On The First Principle Of New Type Two - Dimensional Monolayer
10.	Structural And Boding Feature Of Ae₆Mg₇H₂₆（Ae=Sr,Ba） And （Mg, Al, Y）H₂:First Principle Calculations
11.	First Principle Calculations On B-C-N Compounds With Alternating-stacked BC, CN, BCN Layers And Graphene
12.	Lithium Adatoms And Clusters On PPV: An Ab Initio Investigation
13.	First Principle Calculations On Electrical Properties Effect Of Li On Graphene, BC_x, C_xN Surfaces
14.	First-Principle Calculations For The Adsorption Of Rare Gas Atoms On C/BN Nanotube
15.	First-principle Calculations Of Physical Properties Of Transitional Metal Borides
16.	Interfacial Study Of Two-dimensional Graphene And Silicene Nano-material From First-principle Calculations
17.	Structural And Bonding Feature Of Ti Substituted Mg₂Ni And Mg₂NiH₄:First Principle Calculations
18.	The Study Of ZnSe/Si Heterosturcture Nanowires
19.	Synthesis, Photocatalytic Activity And First-Principle Calculations On Electronic Structure Of Nitrogen-Doped ZnO And ZnO /Ag Nanomaterials
20.	First Principle Calculations And Mechanical Tuning Of Thermoelectric Properties Of Novel Oxychalcogenides
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