Dear QE users,
I want to use the cp.x to simulate the gas molecules desorb from surface at given temperature and pressure. I set the temperature at 300 by ion_dynamics='verlet', ion_temperature='nose', tempw=300, this is ok. But when I set the pressure, it will stop with any error. tabps= .true. , / &PRESS_AI abivol=.true. , P_ext = 0.01, / P.s. I use 5.3 version Thanks. Clarence City University of Hong Kong
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