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Tae In Kim
Tytuł
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PyUNIxMD: A Python‐based excited state molecular dynamics package
IS Lee, JK Ha, D Han, TI Kim, SW Moon, SK Min
Journal of Computational Chemistry 42 (24), 1755-1766, 2021
342021
Silver sulfide nanocrystals as a biocompatible and full-spectrum photocatalyst for efficient light-driven polymerization under aqueous and ambient conditions
C Yu, J Song, TI Kim, Y Lee, Y Kwon, J Kim, J Park, J Choi, J Doh, SK Min, ...
ACS Catalysis 13 (1), 665-680, 2022
152022
Singlet Oxygen Generation from Polyaminoglycerol by Spin-Flip-Based Electron Transfer
JS Nam, Y Hong, CG Lee, TI Kim, C Lee, DH Roh, IS Lee, S Kweon, ...
JACS Au 2 (4), 933-942, 2022
142022
Coupled-and independent-trajectory approaches based on the exact factorization using the PyUNIxMD package
TI Kim, JK Ha, SK Min
New Horizons in Computational Chemistry Software, 153-179, 2022
112022
Electrochemical Formation of a Covalent–Ionic Stage-1 Graphite Intercalation Compound with Trifluoroacetic Acid
B Gurzeda, TI Kim, M Arsakay, M Choe, SH Lee, Z Lee, SK Min, RS Ruoff
Chemistry of Materials 34 (1), 217-231, 2021
52021
Rapid initial state preparation for the quantum simulation of strongly correlated molecules
DW Berry, Y Tong, T Khattar, A White, TI Kim, S Boixo, L Lin, S Lee, ...
arXiv preprint arXiv:2409.11748, 2024
42024
Calculation of exciton couplings based on density functional tight-binding coupled to state-interaction state-averaged ensemble-referenced Kohn–Sham approach
TI Kim, IS Lee, H Kim, SK Min
The Journal of Chemical Physics 158 (4), 2023
32023
Unveiling Energy Transfer Mechanisms in Nanographene-Incorporated Metal–Organic Frameworks
J Lee, E Hwang, TI Kim, E Jin, E Cho, YS Park, SK Min, TH Kwon, W Choe
ACS Materials Letters 6 (4), 1151-1159, 2024
12024
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