First-principles simulation - Globe Thesis

Keyword [First-principles simulation] Result: 1 - 14 \| Page: 1 of 1
1.	DFT Studies Of The Gas Adsorption Properties Of Metal Doped Graphene
2.	The Alloy Finemet Precipitation First Principles Simulation Of The Phase Structure And Magnetic Properties
3.	ITO Material Adsorption Of First-principles Simulation And Precious Load On Its Adsorption Properties
4.	First-principles Simulation On Molecular Interactions And Physical Properties Of Several New Kind Of Energetic Materials
5.	First-principles Simulation And Photocatalytic Activity Of Bi 2 O 3 And Bi 2 O 2 CO 3
6.	Structural Studies Of Molybdate Crystals And Their Melts By In-situhigh Temperature Raman Spectroscopy And First Principles Simulation
7.	A Theoretical Research On The Catalytic Process Of Artificial Carbon Cycle
8.	Antioxidant Behaviors Of Graphene In The Seawater: A First-Principles Simulation
9.	First principles simulation of electrochemical reactions at the metal/liquid interface: Adsorption of sulfuric acid anions on platinum electrodes and the interactions between water and carbon monoxide adsorbed on platinum and platinum-ruthenium alloy
10.	Study On Fabrication And Working Mechanism Of Graphene Piezoresistive Sensor
11.	Study On Solidification Structure Refining And Mechanism Of 409L Ferritic Stainless Steel
12.	Design Of Transition Metal Hydroxide Single-atom Catalyst And Theoretical Study On Its Efficient Catalytic CO Oxidation Mechanism
13.	Atomic Scale Study Of Effect Of Hydrogen On Metallic Cohesion And Grain Boundaries Cleavage
14.	First-principles Simulation On The Polarization Patential/Current For Mg Alloy Corrosion
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