-
Notifications
You must be signed in to change notification settings - Fork 4
Open
Labels
bugSomething isn't workingSomething isn't working
Description
Not sure why, but I get insane velocities when I set do_rotation to True in cctk.quasiclassical.get_quasiclassical_perturbation.
For instance, here's the velocities I get from running a 300 K quasiclassical initialization on test/static/methane_hpmodes.out:
[[ 0.05273943 -0.06015768 0.08881368]
[-10.454403 6.928813 3.9630766 ]
[-22.108727 18.917265 -4.42791 ]
[ 21.231005 -7.157976 -28.53397 ]
[ 10.807802 -17.971182 27.94058 ]]Without rotation, this is what I get:
[[ 0. 0.00822778 0.00959557]
[ 0.04637501 -0.01431042 -0.02822099]
[-0.01059805 -0.01377504 -0.03283611]
[-0.01417696 -0.01534551 -0.00800313]
[ 0.08252529 -0.05453904 -0.04518817]]It's been a while since I've looked at this code — not sure what's wrong!
Metadata
Metadata
Assignees
Labels
bugSomething isn't workingSomething isn't working