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aoterodelaroza / critic2

Analysis of quantum chemical interactions in molecules and solids.
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solve the problem of different result of two yt integration #26

Closed Ceasea closed 5 years ago

Ceasea commented 5 years ago

f%ncpcel stores the CPs information of last YT integration. f%ncpcel should be initialized to sy%c%ncel after each YT integration.

subroutine clear_yt is coded for the initialization.

clear_yt is called to do the initialization in the end of subroutine integrid_driver.