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Browse "Dept. of Materials Science and Engineering(신소재공학과)" by Subject Density functional theory

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Showing results 1 to 10 of 10

1
AgCu 이원계 금속나노입자의 구조적 안정성 및 촉매로서의 응용에 대한 전산모사 연구 = Structural stability of AGCU bimetallic nanoparticles and their application as a catalyst: a computational studylink

신기현; Shin, Ki-Hyun; et al, 한국과학기술원, 2012

2
Effects of phase composition and elemental partitioning on soft magnetic properties of AlFeCoCrMn high entropy alloys

Jung, Chanwon; Kang, Ku; Marshal, Amalraj; Pradeep, Konda Gokuldoss; Seol, Jae-Bok; Lee, Hyuck Mo; Choi, Pyuck-Pa, ACTA MATERIALIA, v.171, pp.31 - 39, 2019-06

3
Effects of Shell Thickness on Ag-Cu2O Core-Shell Nanoparticles with Bumpy Structures for Enhancing Photocatalytic Activity and Stability

Lee, Changsoo; Shin, Kihyun; Lee, Yung Jong; Jung, Chanwon; Lee, Hyuck-Mo, CATALYSIS TODAY, v.303, pp.313 - 319, 2018-04

4
Hierarchical analysis of alloying element effects on gas nitriding rate of Fe alloys: A DFT, microkinetic and kMC study

Kang, Ku; Kwon, Soonho; Lee, Changsoo; Hong, Doosun; Lee, Hyuck Mo, ACTA MATERIALIA, v.174, pp.173 - 180, 2019-08

5
Non-noble metal electrocatalysts for oxygen reduction reaction : DFT study on transition metal nitrides = 비 귀금속 산소환원반응 촉매: 전이금속질화물에 대한 밀도 범함수 이론 연구link

Hong, Doosun; Lee, Hyuck Mo; et al, 한국과학기술원, 2017

6
Preparation of non-woven nanofiber webs for detoxification of nerve gases

Lee, Jaemin; Seo, Eunbyeol; Yoo, Mi; Kim, Sohee; Choi, Jihyun; Jung, Hyunsook; Lee, Hae Wan; et al, POLYMER, v.179, 2019-09

7
Structural stability of AgCu bimetallic nanoparticles and their application as a catalyst: A DFT study

Shin, Kihyun; Kim, Da-Hye; Yeo, Sang-Chul; Lee, Hyuck-Mo, CATALYSIS TODAY, v.185, no.1, pp.94 - 98, 2012-05

8
Study on the catalytic activity of Au-Ti bimetallic nanoparticle on $TiO_2$ support for CO oxidation through DFT method = 밀도범함수 이론을 이용한 이산화티타늄 지지체에 지지된 금-티타늄 이원계 금속 나노입자의 촉매활성 연구link

Bang, Kihoon; 방기훈; et al, 한국과학기술원, 2016

9
Tailoring nanostructured NbCoSn-based thermoelectric materials via crystallization of an amorphous precursor

Jung, Chanwon; Dutta, Biswanath; Dey, Poulumi; Jeon, Seong-jae; Han, Seungwoo; Lee, Hyun-Mo; Park, Jin-Seong; et al, NANO ENERGY, v.80, pp.105518, 2021-02

10
To elucidate the effect of alloying elements for enhanced nitriding of aluminum: A multiscale computational study

Choi, Jungwoo; Yoo, Jaeyoung; Kang, Ku; Lee, Hyuck Mo, MATERIALS CHEMISTRY AND PHYSICS, v.313, 2024-02

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