2nd order quadrupolar in SPINACH

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faq_user
Posts: 49
Joined: Tue Jul 13, 2021 8:33 am

2nd order quadrupolar in SPINACH

Post by faq_user »

I was wondering how to implemented a simple 2nd order quadrupolar simulation on say 23Na (under static conditions). I do not know how to turn on the second-order quadrupolar terms and secondly, i need to detection state to be the central transition. I am unsure on how to implement this. All examples features quadrupolar simulations are done on I=1 nuclei.
kuprov
Posts: 201
Joined: Mon Mar 29, 2021 4:26 pm

Re: 2nd order quadrupolar in SPINACH

Post by kuprov »

Already implemented - set assumptions to labframe, then specify parameters.rframes field when you call the powder context. As for the central transition -- find its operator expansion and set parameters.coil accordingly.
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