|
No. |
Name |
Title |
|
1 |
강승진 |
Mechanical properties of iron based alloys:
ab-initio study |
|
2 |
강일준 |
First principles study of microscopic properties of O-vacancies in InGaZnO4 |
|
3 |
김규봉 |
Ca-decorated 3D Graphitic System for High-Capacity Hydrogen Storage |
|
4 |
김다혜 |
Modification to catalytic reactivity by charging Ag13 nanoclusters |
|
5 |
김맹숙 |
The GW calculation of the native defects in ZnO |
|
6 |
김지훈 |
Ab Initio Study on Electronic Properties of Interfaces between Metal and a HAT-CN Molecule for OLED Applications |
|
7 |
김충현 |
Tight-binding band structure of Na2IrO3 |
|
8 |
김현유 |
CO oxidation by Ag13 and X@Ag12 (X=Pd, Au, Pt, Ni, Cu) core-shell nanoparticles |
|
9 |
김현유 |
Oxidative dehydrogenation of methanol to formaldehyde by isolated vanadium oxide cluster supported on rutile TiO2(110) |
|
10 |
김현유 |
Catalysis by molecular sized reaction center: CO oxidation by doped rutile TiO2 |
|
11 |
김후성 |
Diameter and contact configuration dependence of charge transport across carbon nanotube–metal contacts from first principles |
|
12 |
김흥식 |
Electronic structure, magnetic ground state, and phase diagram of Na2IrO3 |
|
13 |
류병기 |
The electronic structure of oxygen vacancy in Si-HfO2 interface structure |
|
14 |
박미나 |
A density functional theory study of the carbon nanotube-copper interaction |
|
15 |
박소라 |
DFT Calculation of the Geometrical Structure and Electronic Structure of Various Fullerene Derivatives |
|
16 |
박소희 |
Theoretical studies on the interaction of chemical warfare agents with small molecules for chemical sensor applications |
|
17 |
박재현 |
Ultrathin (2×2) Gd Nanowires Encapsulated in Carbon Nanotubes: First-Principles Calculations |
|
18 |
박지상 |
The electronic structure of Ge/Si core/shell nanowires |
|
19 |
박찬현 |
Native point defects in CoSb3 |
|
20 |
박홍래 |
Ab initio investigation of structural and electronic properties for the Sm doped CeO2 |
|
21 |
백승수 |
Electronic structures of Cr-based chalcogenide magnetic semiconductors FeCr2Se4 and FeCr2S4 |
|
22 |
성동철 |
Interfacial structure and electronic structure of HAT-(CN)6 on graphene |
|
23 |
손원준 |
Carrier Generation and its Spatial Distribution in Intrinsic n-type SrTiO3-LaAlO3 Interface |
|
24 |
양난희 |
Magnetism in Oxide-Supported Pt Films |
|
25 |
여진남 |
Step-dependent Oxidation at Vicinal Si(001) Surfaces |
|
26 |
오영준 |
Atomic and electronic structure of Li13Si4 |
|
27 |
윤원석 |
Magnetocrystalline Anisotropy of Zinc-Blende CrTe Thin Film:Density Functional Study |
|
28 |
이근식 |
First principles study of HfO2:GaAs interface passivation by Si and Ge |
|
29 |
이보라 |
First-principles study on exfoliation of graphene sheet from SiC substrate using hydrogen |
|
30 |
이재찬 |
Jahn-Teller coupling at the interfaces of doped SrTiO3/Sr1-xLaxTiO3 superlattices |
|
31 |
이재찬 |
Oxygen vacancy in InGaO3(ZnO)m : first principles study |
|
32 |
이재찬 |
Oxygen-vacancy-induced ferromagnetism in CeO2 from first principles |
|
33 |
장윤희 |
Adsorption and diffusion of metal adatoms on Bi2Te3 (001) surface |
|
34 |
전상호 |
First-principles study on charged graphene nanoribbons |
|
35 |
조은애 |
Electronic and structural properties of amorphous Ge2Sb2Te5: melt-quench vs. ideal glass |
|
36 |
채기성 |
Effects of magnetic in-plane anisotropy on magnetic and electronic properties in a Co/MgO/Co magnetic tunnel junction system |
|
37 |
최융기 |
Computational Modeling of Transport Phenomena in Polymer Electrolyte Membranes, Nafion and Hydrocarbon Membrane |
|
38 |
최은애 |
Quasiparticle energy calculations of the defect states of oxygen vacancy in HfO2 |
|
39 |
최희성 |
Theoretical and Experimental Study of Tip Electronic Structures in Scanning Tunneling Microscope |
|
40 |
Odkhuu Dorj |
Magneto-crystalline anisotropy and magnetostriction of the Fe1-xSix alloys: A first-principles study |
|
41 |
Sutassana Na Phattalung |
First principles study of co-doping in TiO2 |