Tight-binding calculations of optical matrix elements for conductivity using non-orthogonal atomic orbitals: Anomalous Hall conductivity in bcc Fe CC Lee, YT Lee, M Fukuda, T Ozaki
Physical Review B 98 (11), 115115, 2018
43 2018 Chemical mechanism of surface‐enhanced Raman scattering spectrum of pyridine adsorbed on Ag cluster: Ab initio molecular dynamics approach JP Su, YT Lee, SY Lu, JS Lin
Journal of Computational Chemistry 34 (32), 2806-2815, 2013
30 2013 Density functional study of the interfacial electron transfer pathway for monolayer-adsorbed InN on the TiO JS Lin, WC Chou, SY Lu, GJ Jang, BR Tseng, YT Li
The Journal of Physical Chemistry B 110 (46), 23460-23466, 2006
26 2006 A structure map for AB M Fukuda, J Zhang, YT Lee, T Ozaki
Materials Advances 2, 4392-4413, 2021
25 2021 OpenMX Viewer: A web-based crystalline and molecular graphical user interface program YT Lee, T Ozaki
Journal of Molecular Graphics and Modelling 89, 192-198, 2019
12 2019 Ab-initio molecular dynamics study of ethylene adsorption onto Si(001) surface: short‐time Fourier transform analysis of structural coordinate autocorrelation function YT Lee, JS Lin
Journal of Computational Chemistry 34 (31), 2697-2706, 2013
12 2013 A novel theoretical study of thermally-induced reaction and vibration dynamics of methanol dissociative adsorption onto a Si(001) surface YT Lee, JS Lin
Royal Society of Chemistry Advances 6 (2), 1491-1502, 2016
8 2016 Unfolding optical transition weights of impurity materials for first-principles LCAO electronic structure calculations YT Lee, CC Lee, M Fukuda, T Ozaki
Physical Review B 102 (7), 075143, 2020
6 2020 Optimized geometry, electronic structure and Ag adsorption property of nanosheet graphene with different symmetry shapes: a theoretical investigation YJ Chen, YT Lee, PL Yeh, BC Wang
Research on Chemical Intermediates 43 (6), 3613-3620, 2017
5 2017 Atomically-thin metallic Si and Ge allotropes with high Fermi velocities CE Hsu, YT Lee, CC Wang, CY Lin, YY Takamura, T Ozaki, CC Lee
Physical Review B 107 (11), 115410, 2023
4 2023 Realization of intrinsically broken Dirac cones in graphene via the momentum-resolved electronic band structure CC Lee, M Fukuda, YT Lee, T Ozaki
Journal of Physics: Condensed Matter 30 (29), 295502, 2018
4 2018 Broken Dirac cones in graphene: Spectral weight in the one-carbon-atom zone CC Lee, M Fukuda, YT Lee, T Ozaki
arXiv:1707.02525, 6, 2017
4 * 2017 Structure map of AB M Fukuda, J Zhang, YT Lee, T Ozaki
arXiv:1904.06047, 2019
3 2019 Tomography Scan of Charge Density Wave in NbSe JY Wu, YT Lee, GH Chen, ZH Li, CT Lee, JY Hsu, CN Kuo, JJ Lin, ...
arXiv:2303.12053, 2023
2 2023 Breaking the Trade-Off Between Mobility and On-Off Ratio in Oxide Transistors YC Chang, ST Wang, YT Lee, CS Huang, CH Hsu, TT Weng, CC Huang, ...
Advanced Materials, 2413212, 2024
2024 Revealing the Charge Density Wave caused by Peierls instability in two-dimensional NbSe YT Lee, PT Chen, ZH Li, JY Wu, CN Kuo, CS Lue, CT Wu, CC Kuo, ...
ACS Materials Letters 6 (7), 2941-2947, 2024
2024 Revealing the Charge Density Wave caused by Peierls instability in two-dimensional NbSe YT Lee, PT Chen, ZH Li, JY Wu, CN Kuo, CS Lue, CT Wu, CC Kuo, ...
arXiv:2211.01203, 2022
2022 Quantum computer simulation of surface chemical reactions and vibration JS Lin, SY Lu, YT Lee
Impact 2018 (11), 69-71, 2018
2018 Reaction dynamics of molecular adsorptions onto silicon surface and their time-resolved vibrational spectra unveiled by ab-initio molecular dynamics and time-frequency analysis YT Lee
Tamkang University ( DOI: 10.6846/TKU.2014.00927 ), 2014
2014 Theoretical studies of desorption of tert-Butylacetylacetate on Si(100) surface and ethanol on Pd(111) surface YT Lee
Tamkang University ( DOI: 10.6846/TKU.2007.00437 ), 2007
2007 
Taisuke OzakiProfessor, ISSP, University of TokyoEmail verificata su issp.u-tokyo.ac.jp
