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<div><span id="Tutorial02" style="font-size: 150%;"> Fitting the complex refractive index by manual mode </span> </div> | <div><span id="Tutorial02" style="font-size: 150%;"> Fitting the complex refractive index by manual mode </span> </div> | ||
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: In this tutorial, we will use the C-C-O asymmetric stretching region of ethanol as an example | : In this tutorial, we will use the C-C-O asymmetric stretching region of ethanol as an example. The initial parameters in the fitting procedure are set by users. | ||
: 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_ethanol.txt" target="_blank">Here</htmltag></u>. Use Ctrl + s to save the file in your local computer. The file name is “data_ethanol.txt”. | : 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_ethanol.txt" target="_blank">Here</htmltag></u>. Use Ctrl + s to save the file in your local computer. The file name is “data_ethanol.txt”. | ||
: Then, please move to the Main Package page. | : Then, please move to the Main Package page. | ||
[[File:Nav-Main.png|1000px]] | [[File:Nav-Main.png|1000px]] | ||
: Upload the“data_ethanol.txt” in ① and set the other parameters according to the following figure. (For the meanings of each part, please refer to ➡[[ | : Upload the“data_ethanol.txt” in ① and set the other parameters according to the following figure. (For the meanings of each part, please refer to ➡[[ComplexRI Manual#Manual#Manual|Manual]].) | ||
:[[File:5Newtutorial02.png|1600px]] | :[[File:5Newtutorial02.png|1600px]] | ||
: Now, please click the “Execute Fitting” to start fitting. | : Now, please click the “Execute Fitting” to start fitting. | ||
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: The Result should be like follows. | : The Result should be like follows. | ||
[[File:5Newres_tuto02.png|750px]] | [[File:5Newres_tuto02.png|750px]] | ||
: The meaning of each output can be found in ➡[[ | : The meaning of each output can be found in ➡[[ComplexRI Manual#Manual#Manual|Manual]] | ||
[[Tutorial01|Tutorial01]] | [[Tutorial01|Tutorial01]] | ||
2022年2月15日 (火) 02:02時点における版
Fitting the complex refractive index by manual mode
- In this tutorial, we will use the C-C-O asymmetric stretching region of ethanol as an example. The initial parameters in the fitting procedure are set by users.
- 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_ethanol.txt”.
- Then, please move to the Main Package page.
- Upload the“data_ethanol.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 Tutorial02
- The Result should be like follows.
- The meaning of each output can be found in ➡Manual