충북대학교 공업화학과

홈 연구실소개 나노소재 이론 및 시뮬레이션 연구실

나노소재 이론 및 시뮬레이션 연구실

https://atomlab.co.kr/

연구실소개

교수이미지

김한슬 교수

Our ultimate aim is to deepen the understanding and practical application of innovative materials across various domains, leveraging state-of-the-art simulations, theoretical frameworks, and data-driven strategies. Our focus extends to a wide array of nanomaterials, including but not limited to low-dimensional entities such as 2D materials and 0D quantum dots, organic-inorganic hybrid compositions, and innovative ionic crystals. We explore their charge transportation and energy transference properties to pave the way for revolutionary advancements in semiconductors, sensors, and energy devices of the next generation. To realize our objectives, we employ multiscale modeling grounded in first-principles simulations alongside data-driven high-throughput material screening techniques. Furthermore, we are committed to developing multiscale simulation methodologies that seamlessly integrate in-depth academic research with industrial innovations in material science.
Additionally, we emphasize the importance of validating our theoretical models through experimental procedures and the direct fabrication of new materials based on these theories. This comprehensive approach not only enriches our simulations but also ensures a tangible impact on the development of novel materials, embodying a synergy between theoretical insights and practical applications.

구성원

  • Advisor 김한슬

    • 학부연구원: 김현기, 최의영, 이동호, 홍민택, 김용욱

주요연구분야

  • - Atomistic simulations for next-generation semiconductors and energy materials

  • - Data-driven materials discovery and experimental validation of novel materials

  • - Multiscale simulations of materials to bridge academia and industries

주요업적

  • [1] D Kim, G Cho, YH Kim, JH Kwon, Y Oh, M Yang, S Jee, IS Lee, MJ Si, Y Jung, HY Yang, Y Ahn, BK Kim, C Kim, HS Kim*, SW Baek*, Multi-Facet Passivation of Ternary Colloidal Quantum Dot Enabled by Quadruple-Ligand Ensemble toward Efficient Lead-Free Optoelectronics. Adv. Energy Mater. 14, 2302579 (2024) [Cover] [스마트경제, 뉴시스 외 다수]

  • [2] TG Yun†, J Lee†, HS Kim†, JY Cheong, SH Kim, Y Kim*, S Lee, ID Kim*, π-Bridge Spacer Embedded Electron Donor-Acceptor Polymer for Flexible Electrochromic Zn-ion Batteries, Adv. Mater. 2301141 (2023) [† equal contributions] [Cover] [서울경제, 머니투데이 외 다수]

  • [3] D Lee, SJ Lee, JH Kim, G Kim, WG Jung, J Park, YC Kang, YH Kim, M Song*, HS Kim*, JW Choi*, Multi-ion controllable metal halide ionic structure for selective short- and long-term memorable synaptic devices, Nano Today, 55, 102184 (2024) [국제뉴스, 베리타스알파 외 다수]

  • [4] D Lee, SJ Lee, JH Kim, J Park, YC Kang, M Song, HW Lee, HS Kim* and JW Choi*, Multimodal Gas Sensor Detecting Hydroxyl Groups with Phase Transition Based on Eco-Friendly Lead-Free Metal Halides, Adv. Funct. Mater. 32, 2202207 (2022) [Inside Front Cover] [헤럴드경제, 뉴시즈 외 다수]

  • [5] MS Ramzan, AB Kuc*, HS Kim*, Electronic fingerprint mechanism of NOx sensor based on single-material SnP3 logical junction, npj Computational Materials 8, 1-10 (2022)

  • [6] OH Gwon†, JY Kim†, HS Kim†, SJ Kang, M Park, DS Lee, YJ Kim, S Ahn, J Kim, SJ Cho and YJ Yu*, Systematic design and demonstration of multi-bit generation in layered materials heterostructures floating-gate memory, Adv. Funct. Mater. 31, 2105472 (2021) [† equal contributions] [Cover] [베리타스알파, 충청뉴스 외 다수]

  • [7] HS Kim*, Computational design of a switchable heterostructure electrocatalyst based on a two-dimensional ferroelectric In2Se3 material for the hydrogen evolution reaction, J. Mater. Chem. A 9, 11553 (2021)

주요연구장비

  • High-performance cluster computer, 3D printer, RF sputter, DC sputter, spin coater, bake oven

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