| # | Line 41 | Line 41 | module notifyCutoffs | |
|---|---|---|
| 41 | if (abs(rcut-rsw) .lt. 0.0001) then | |
| 42 | do_shift = .true. | |
| 43 | endif | |
| 44 | + | write(*,*) 'rcut, rsw, do_shift = ', rcut, rsw, do_shift |
| 45 | ||
| 46 | call setRlistDF( rlist ) | |
| 47 | call setCutoffsRF( rcut, rsw ) | |
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