「Tutorial01」の版間の差分
ナビゲーションに移動
検索に移動
| 2行目: | 2行目: | ||
---- | ---- | ||
: In this tutorial, we will use the C=O stretching region of dimethyl carbonate (DMC) as an example to show the automatic fitting procedure in ComplexRI. | : In this tutorial, we will use the C=O stretching region of dimethyl carbonate (DMC) as an example to show the automatic fitting procedure in ComplexRI. | ||
: The ATR-IR experimental data file in this tutorial can be downloaded <u><htmltag tagname="a" href="https://comp.chem.tohoku.ac.jp/media/Tutorial/data_DMC_2col.txt" target="_blank">Here</htmltag></u>. Use Ctrl + s to save the file in your local computer. | : The ATR-IR experimental data file in this tutorial can be downloaded <u><htmltag tagname="a" href="https://comp.chem.tohoku.ac.jp/media/Tutorial/data_DMC_2col.txt" target="_blank">Here</htmltag></u>. Use Ctrl + s to save the file in your local computer. The file name is “data_DMC_2col.txt”. | ||
: Then, please move to the Main Package page. | : Then, please move to the Main Package page. | ||
[[File:Main.png|1000px]] | [[File:Main.png|1000px]] | ||
2022年2月14日 (月) 08:10時点における版
Fitting the complex refractive index by automatic mode
- In this tutorial, we will use the C=O stretching region of dimethyl carbonate (DMC) as an example to show the automatic fitting procedure in ComplexRI.
- The ATR-IR experimental data file in this tutorial can be downloaded Here. Use Ctrl + s to save the file in your local computer. The file name is “data_DMC_2col.txt”.
- Then, please move to the Main Package page.
- Upload the“data_DMC_2col.txt” in ① and set the other parameters according to the following figure. (For the meanings of each part, please refer to ➡Manual.)
- Now, please click the “Execute Fitting” to start fitting.
Results of Tutorial01
- The Result should be like follows.
- The meaning of each output can be found in ➡Manual