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forum:data:2020:printing_several_spectra [2020/01/13 18:54] – Created from the form at forum:start Riccardo Piomboforum:data:2020:printing_several_spectra [2021/02/08 21:54] (current) – Maurits W. Haverkort
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 I want to do a series of runs with Quanty to compute several PES Spectrum calling each result "PESSpectra(i,j).dat" where (i,j) are two indexes that go from 1 to 3. I set my code in the following way: I want to do a series of runs with Quanty to compute several PES Spectrum calling each result "PESSpectra(i,j).dat" where (i,j) are two indexes that go from 1 to 3. I set my code in the following way:
  
 +<code>
 Orbitals Orbitals
 . .
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 end end
  
 +</code>
  
 when printing the spectrum on the file I write for example: when printing the spectrum on the file I write for example:
 +<code>
 G_dSW.Print({{"file","PES_dSpectra(%d,%d).dat", {i, j} }}) G_dSW.Print({{"file","PES_dSpectra(%d,%d).dat", {i, j} }})
 +</code>
 but Quanty gives me an error. I check the .pdf user guide to see how to correct such an error but I don't find anything useful under "G.Print" section. Could someone please help me? but Quanty gives me an error. I check the .pdf user guide to see how to correct such an error but I don't find anything useful under "G.Print" section. Could someone please help me?
  

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