| 研究生: |
林冠宏 Lin, Guan-Hong |
|---|---|
| 論文名稱: |
I. 摻雜硼或氮的二氧化鈦:製備及可見光催化 II. 2,4-二溴吡啶於銅(100)上斷裂碳-溴鍵的理論探討 I. B and/or N-doped TiO2: Synthesis and Visible-light Catalysis II. Theoretical Study on C-Br Bond Scission of 2,4-Dibromopyridine on Cu(100) |
| 指導教授: |
林榮良
Lin, Jong-Liang |
| 學位類別: |
碩士 Master |
| 系所名稱: |
理學院 - 化學系 Department of Chemistry |
| 論文出版年: | 2013 |
| 畢業學年度: | 101 |
| 語文別: | 中文 |
| 論文頁數: | 100 |
| 中文關鍵詞: | 二氧化鈦 、光催化 、銅(100) 、2,4-二溴吡啶 |
| 外文關鍵詞: | Titanium dioxide, Photocatalyzation, Cu(100), 2,4-Dibromopyridine |
| 相關次數: | 點閱:78 下載:1 |
| 分享至: |
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二硼化鈦、氮化鈦於硝酸水溶液中經水熱反應可製備二氧化鈦,在特定條件下能分別產生含雜元素的銳鈦礦相(含硼、氮元素)與金紅石相(含氮元素)二氧化鈦。混合的前趨物則可生成混合晶相的二氧化鈦,具有硼與氮雜質,且有最佳的可見光催化能力,包括降解亞甲藍以及水中產氫氧自由基。
密度泛函理論計算了2,4-二溴吡啶分子在銅(100)表面最可能的吸附結構、斷裂碳-溴鍵的反應路徑以及能量學,這些結果有助於瞭解2,4-二溴吡啶在銅表面上的化學過程。
Hydrothermal treatments of titanium diboride or titanium nitride in nitric acid aqueous solutions have been performed to prepare heteroelement-doped titanium dioxide with anatase phase (containing elements B and N) or rutile phase (containing element N) respectively. Mixture of these two precursors give rise to mixed crystals, containing boron and nitrogen impurity and having the highest visible-light activity, including degradation of methylene blue and formation of hydroxyl radical in water.
The computation based on density functional theory has been investigated for 2,4-dibromopyridine (2,4-DBP) / Cu(100) system to obtain the adsorption geometries, C-Br bond dissociation pathways, and related energetics. These results assist in understanding the chemical processes of 2,4-DBP on copper surfaces.
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