材料科學工程學系
陳馨怡
副教授
| 聯絡電話 | 03-5715131#34248 |
| 辦公室 | 工科舊館513室 |
| hsinyi.tiffany.chen@gapp.nthu.edu.tw | |
| 學歷 | 英國倫敦大學化學系 博士 |
| 個人網站 | 能源材料計算模擬實驗室 |
| 研究專長 | 材料電腦模擬 |
經歷
| 服務機關 | 職稱 | 起迄年月 |
|---|---|---|
| 國立台灣大學材料科學與工程學系 | 助理教授 | |
| 中央研究院原子與分子科學研究所 | 研究助理 | |
| 義大利米蘭比可卡大學材料科學系 | 博士後研究員 |
Publications
22. Z. Li, K. H.-Y. T. Chen, Schouteden, P. Thomas, K. Houben, T.-W. Liao, C. Van Haesendonck, G. Pacchioni and P. Lievens and E. Janssens “Size-Dependent Penetration of Gold Nanoclusters through a Defect-Free, Nonporous NaCl Membrane, Nano Lett 16,. 3063-70 (2016). IF=13.779
21. H.-Y. T. Chen and G. Pacchioni “Role of Oxide Reducibility in the Deoxygenation of Phenol on Ruthenium Clusters Supported on the Anatase Titania (1 0 1) Surface, ChemCatChem 8, 2492-99 (2016). IF=4.724
20. H.-Y. T. Chen, S. Tosoni, G. Pacchioni “A DFT study of the acid-basic properties of anatase TiO2 and tetragonal ZrO2 by adsorption of CO and CO2 probe molecules” Surf. Sci. 652, 163-71 (2016). IF=1.925
19. S. Tosoni, H.-Y. T. Chen, G. Pacchioni “A DFT study of the reactivity of anatase TiO2 and tetragonal ZrO2 stepped surfaces compared to the regular (101) terraces” ChemPhysChem 16, 3642-51 (2015). IF=3.419
18. H.-Y. T. Chen, S. Livraghi, E. Giamello and G. Pacchioni “Mechanism of oligomerization of C2H2 on anatase TiO2 (101) and (001) surfaces and their chemical reduction: a combined Electron Paramagnetic Resonance and Density Functional Theory study” ChemPlusChem DOI: 10.1002/cplu.201500383 (2015). IF=3.242
17. H.-Y. T. Chen, C. Wang, X. Wu, C. R. A. Catlow and J. Xiao “Iridicycle-catalyzed imine reduction: an experimental and computational study of the mechanism” Chem – Eur. J. 21, 16564-77 (2015). IF=5.731
16. H.-Y. T. Chen, S. Tosoni, G. Pacchioni “Hydrogen adsorption, dissociation, and spillover on Ru10 clusters supported on anatase TiO2 and tetragonal ZrO2 (101) surfaces” ACS catalysis 5, 5486-5495 (2015). IF=9.312
15. S. Tosoni, H.-Y. T. Chen, G. Pacchioni “A DFT study of Ni clusters depositionon titania and zirconia (101) surfaces” Surf Sci Doi:10.1016/j.susc.2015.04.004 (2015). IF=1. 876
14. Z. Li, H.-Y. T. Chen, K. Schouteden, K. Lauwaet, E. Janssens, C. Van Haesendonck, G. Pacchioni, and P. Lievens “Lateral manipulation of atomic vacancies in ultrathin insulating films” ACS Nano 9, 5318-5325 (2015). IF=13.334
13. Z. Li, H.-Y. T. Chen, K. Schouteden, E. Janssens, C. Van Haesendonck, P. Lievens, and G. Pacchioni “Spontaneous doping of two-dimensional NaCl films with Cr atoms: aggregation and electronic structure” Nanoscale 7, 2366-2373 (2015). IF=7.760
12. H.-Y. T. Chen, S. Tosoni, G. Pacchioni “Adsorption of Ruthenium Atoms and Clusters on Anatase TiO2 and Tetragonal ZrO2(101) Surfaces: A Comparative DFT Study” J. Phys. Chem. C 119, 10856−10868 (2015). IF=4.835
11. H.-Y. T. Chen and G. Pacchioni “Properties of two-dimensional insulators: a DFT study of Co adsorption on NaCl and MgO ultrathin films” Phys. Chem. Chem. Phys. 16, 21838-45 (2014). IF=4.198
10. H.-Y. T. Chen, L. Giordano, G. Pacchioni “Adsorption properties of two-dimensional NaCl: a DFT study of the interaction of Co, Ag, and Au atoms with NaCl/Au(111) ultrathin films” J. Phys. Chem. C 118, 12353-12363 (2014). IF=4.835
9. Z. Li, H.-Y. T. Chen, K. Schouteden, K. Lauwaet, L. Giordano, M. I. Trioni, E. Janssens, V. Iancu, C. Van Haesendonck, P. Lievens, and G. Pacchioni “Self-doping of ultrathin insulating films by transition metal atoms” Phys. Rev. Lett. 112, 026102 (2014). IF=7.728
8. H.-Y. T. Chen, L. Giordano, G. Pacchioni “From heterolytic to homolytic H2 dissociation on nanostructured MgO(001) films as a function of the metal support” J. Phys. Chem. C 117, 10623-10629 (2013). IF=4.835
7. G. Pacchioni, L. Giordano, H.-Y. T. Chen, and S. Prada, “Unusual chemistry of oxides at the nanoscale”, Abstracts of Papers of the American Chemical Society, 246, Amer. Chem. Soc., Sep (2013).
6. C. Wang, H.-Y. T. Chen, J. Bacsa, C. R. A. Catlow and J. Xiao “Synthesis and X-ray structures of cyclometalated iridium complexes including the hydrides” Dalton T. 42, 935–940 (2013). IF=4.097
5. H.-Y. T. Chen, D. Di Tommaso, G. Hogarth, and C. R. A. Catlow “The effects of ligand variation on enantioselectivity hydrogenation catalysis by Ru(H)2(diphosphine)(amine) complexes” Dalton T. 41, 1867–1877 (2012). IF=4.097
4. H.-Y. T. Chen, D. Di Tommaso, G. Hogarth, and C. R. A. Catlow “Correlating enantioselectivity with activation energies in the asymmetric hydrogenation of acetophenone catalysed by Noyori-type complexes” Catal. Lett. 141, 1761–1766 (2011). IF=2.291
3. H.-Y. T. Chen, D. Di Tommaso, G. Hogarth, and C. R. A. Catlow “trans-FeII(H)2(diphosphine)(d
2. J. P. Chou, H.-Y. T. Chen, C. R. Hsing, C. M. Chang, C. Cheng, and C. M. Wei “13-atom metallic clusters studied by density functional theory: Dependence on exchange-correlation approximations and pseudopotentials” Phys. Rev. B 80, 165412–165419 (2009). IF=3.736
1. H.-Y. T. Chen, W. C. J. Wei, K. C. Hsu, C. S. Chen “Adsorption of Polyacrylic Acid (PAA)
on (0001) α-Al2O3 surface” J. Am. Ceram. Soc. 90, 1709–1716 (2007). IF=2.428, 1/25
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