EasySpin forum

Dear katarkon,

Thank you very much for your swift reply and suggestion.
I will try to save each figure and then then merge them into one figure by using another software (e.g., inkscape).

Thanks

Regards,
kyuichi

Hi All, I am going to simulate EPR specrtra of radical cation and radical anion of BINOLs using garlic. I checked examples shown in "Examples" page of Easyspin page. A page of "pentacene.m" is a script of pentacene radical anion and radical cation. In the script, the two spectra ...

Dear Stoll, Thank you very much for your swift reply and suggestion. I checked a page of "biphenyl.m" (Biphenyl radical anion ). The script only considers protons (H), not carbons (C). In some case, it is better to consider other atoms such as carbon, but I little bit confuse how to decide...

Hi All, I am a beginner of easyspin and matlab and would like to ask for your help with the difficulties that I am facing. After setting up a calculation on Orca, then using easyspin with command orca2easyspin(.prop file). And then, I want to simulate the EPR spectrum from the parameters of cationra...