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Showing 1 to 2 of 2 for “"spectra simulation"”.
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Weighted two-band target entropy minimization for the reconstruction of pure component mass spectra: Simulation studies and the application to real system
… suitable for reconstructing discrete pure spectra (such as MS) from mixture systems was developed. It used 1) Peaksa?? Height instead of their derivatives in objective function. 2) Weighting VT vectors to lower the effect of noise on systems. 3) A two-peak targeting method to deal with …
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Theoretical study of electronic absorption spectra and photodissociation dynamics of atmospherically relevant molecules
… are available. We simulate electronic absorption spectra of atmospherically relevant sulfur-containing molecules, including sulfuric acid, which is present in Earths' atmosphere and OSSO, which was recently identified in the atmosphere of Venus. We also simulate electronic absorption spectra for a …