Searched refs:ftmp_coord (Results 1 – 2 of 2) sorted by relevance
| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | colvar_methods.F | 5336 ALLOCATE (ftmp_coord(3, n_atoms_to))
5337 ftmp_coord = 0.0_dp
5367 ftmp_coord(1, jj) = dfunc_coord*xij(1)
5368 ftmp_coord(2, jj) = dfunc_coord*xij(2)
5369 ftmp_coord(3, jj) = dfunc_coord*xij(3)
5377 ftmp(1) = ftmp_coord(1, jj)*dfunc
5378 ftmp(2) = ftmp_coord(2, jj)*dfunc
5379 ftmp(3) = ftmp_coord(3, jj)*dfunc
5381 ftmp(1) = -ftmp_coord(1, jj)*dfunc
5382 ftmp(2) = -ftmp_coord(2, jj)*dfunc
[all …]
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | colvar_methods.F | 5336 ALLOCATE (ftmp_coord(3, n_atoms_to))
5337 ftmp_coord = 0.0_dp
5367 ftmp_coord(1, jj) = dfunc_coord*xij(1)
5368 ftmp_coord(2, jj) = dfunc_coord*xij(2)
5369 ftmp_coord(3, jj) = dfunc_coord*xij(3)
5377 ftmp(1) = ftmp_coord(1, jj)*dfunc
5378 ftmp(2) = ftmp_coord(2, jj)*dfunc
5379 ftmp(3) = ftmp_coord(3, jj)*dfunc
5381 ftmp(1) = -ftmp_coord(1, jj)*dfunc
5382 ftmp(2) = -ftmp_coord(2, jj)*dfunc
[all …]
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