Search found 3 matches

by warly
Tue Jul 19, 2016 8:57 am
Forum: General forum
Topic: Fast-motion simulation with multiple non-equivalent nuclei
Replies: 3
Views: 2267

Re: Fast-motion simulation with multiple non-equivalent nucl

For the function exchange there is no correlation time included, right?
by warly
Thu Jul 14, 2016 3:14 am
Forum: General forum
Topic: Fast-motion simulation with multiple non-equivalent nuclei
Replies: 3
Views: 2267

Fast-motion simulation with multiple non-equivalent nuclei

Hi everyone, I try to simulate a RT, fast-motion CW spectrum with a system containing 1 nitrogen atom and 12 equivalent protons. (Sys.Nucs = '14N,1H', Sys.n = [1,12]) garlic is not working for that, since it's only for exactly one electron and for multiple equivalent nuclei, but not for multiple dif...
by warly
Thu Mar 10, 2016 10:49 am
Forum: General forum
Topic: Multi-component esfit with different functions possible?
Replies: 1
Views: 1708

Multi-component esfit with different functions possible?

Hello, is it possible to simulate a spectrum with multiple components with esfit, where I need to use different functions for the different components? For example for the more immobile component chili and for the fast component garlic. I guess I have to write a user-defined simulation function for ...