포스터발표 Home > 포스터발표
제 14회 고등과학원 전자구조계산 학회 Poster Session

* 포스터세션은 Banquet 장소(고등과학원 대강당 로비)에서 진행됩니다.

 
강기재 First-principles study on
K center in nitrogen-deficient amorphous Si3N4		 1-POS Board 1
권정안 Density functional theory study on durable titanium nitride (TiN) electrocatalyst supports 1-POS Board 2
김도훈 Branching ratio calculation based on first principles for
5d, 4d and 3d transition metals		 1-POS Board 3
김범섭 An investigation of the shift current
using time-dependent density functional theory		 1-POS Board 4
김영재 Subfemtosecond optical processing with the wide-gap semiconductor band engineering 1-POS Board 5
Thekkepat, Krishnamohan Towards a Stable Rare-earth Free Permanent Magnet:
The stability of Fe16N2		 1-POS Board 6
Liu Kai Oxygen adsorption on Ge [001] nanowire 1-POS Board 7
박가람 Van der Waals approximation:
interaction between surface and molecule		 1-POS Board 8
박선호 First-Principle Study on
Triazine and Heptazine-based Graphitic Carbon Nitride Structures		 1-POS Board 9
박은원 Intrinsic and Extrinsic Defects (Au, O) in MoTe2 Few Layers 1-POS Board 10
박재홍 Intrinsic electric polarization and its switching mechanism in 2D transition metal dichalcogenides having polar symmetry 1-POS Board 11
박환열 Ab initio study of the reactivity of B2H6 molecule on TiN Surfaces for Tungsten Atomic Layer Deposition 1-POS Board 12
변성재 Strain effect on the electronic properties of
Copper doped CdSe nanoplatelet		 1-POS Board 13
성하준 A novel superconducting Si allotrope and
its high pressure chemical precursor		 1-POS Board 14
송도형 Band Structure Modification of CdnSen Quantum Dots through External Electric Field: Ab-initio Studies 1-POS Board 15
심재훈 Implementation of the DFT+DMFT: Natural atomic orbitalsbased construction of the correlated subspace 1-POS Board 16
여인원 Equilibrium crystal shape of
GaAs and InAs by ab-initio thermodynamics		 1-POS Board 17
여현우 Development of a first-principles approach
for the finite-bias simulation
and its verifications using molecule junction systems.		 1-POS Board 18
Okyay, Mahmut Sait Time-reversal broken characteristics driven by circularlypolarized external perturbation:
the comparison of a rotating electric field to magnetic field.		 1-POS Board 19
Wang, Chongze Competing magnetic orderings in two-dimensional hexagonal organometallic lattices 1-POS Board 20
유동선 Atomic energies of high-dimensional neural network potential 1-POS Board 21
윤영채 SNU Materials Data Center (SNUMDC): The efficient and high performance material database platform 1-POS Board 22
윤원석 Structural stability and thermoelectric performance of twodimensional ZnPS3 and ZnPSe3 1-POS Board 23
윤홍기 Analytic continuation via “domain-knowledge free” machine learning 1-POS Board 24
이경미 Optical-Harmonic-Generation from magnetic semiconductor EuX 1-POS Board 25
이경풍 Ab-initio calculations on Aluminum dopant in SrTiO3 1-POS Board 26
이동헌 First-principles study of metal-doped amorphous Ge2Sb2Te5 1-POS Board 27
이미소 Screening Non-oxide High-k Materials
by High-throughput Ab Initio Calculations		 1-POS Board 28
이성우 Evidence for Covalent Interaction
in WS2/Graphene van der Waals Heterostructure		 1-POS Board 29
이승준 Novel two-dimensional van der Waals materials:
layered IV-V compounds		 1-POS Board 30
이형근 Revisiting of molecular Jeff band structure
in lacunar spinel compounds through DFT+U
with charge-dependent correlation functional		 1-POS Board 31
장보규 Experimental and Theoretical study for Spin State Transition in FeO2 1-POS Board 32
장승우 Charge density functional plus U theory of LaMnO3:
Phase diagram, electronic structure, and magnetic interaction		 1-POS Board 33
장승훈 Molecular films on dielectrics probed by a graphene overlayer 1-POS Board 34
정민용 Spin-orbit coupling effect in frustrated magnetism of
Jeff=3/2 lacunar spinel GaTa4Se8		 1-POS Board 35
정상민 Effect of spin-orbit coupling on the zigzag nanoribbon structures of
Bi(111) and Sb(111) bilayers		 1-POS Board 36
정원석 Overcoming the sampling bias problem
in neural network potentials using Gaussian density function		 1-POS Board 37
진태원 Crystal structure prediction of transition metal binary alloy:
Orbital-spin occupancy rule		 1-POS Board 38
최이철 Identification of intrinsic surface defects
in a thin PtSe2 film from first-principles		 1-POS Board 39
한규승 Phase diagram and electronic structures of
Ga(As,Sb) solid solution using cluster expansion method		 1-POS Board 40
한우현 Green phosphorus
with tunable direct band gap and high electron mobility		 1-POS Board 41
홍지숙 Theoretical Study on the Origin of
Giant Rashba-type Spin Splitting in Bi/Ag(111) Alloy System		 1-POS Board 42
강성우 Electrochemical CO2 reduction reaction at sulfur vacancy of
MoS2: Role of hyper-charged states		 1-POS Board 43