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Searched refs:natom_plumed (Results 1 – 2 of 2) sorted by relevance

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dmetadynamics.F157 natom_plumed = subsys%particles%n_els
259 natom_plumed = subsys%particles%n_els
260 ALLOCATE (pos_plumed_x(natom_plumed))
261 ALLOCATE (pos_plumed_y(natom_plumed))
262 ALLOCATE (pos_plumed_z(natom_plumed))
264 ALLOCATE (force_plumed_x(natom_plumed))
265 ALLOCATE (force_plumed_y(natom_plumed))
266 ALLOCATE (force_plumed_z(natom_plumed))
268 ALLOCATE (mass_plumed(natom_plumed))
274 DO i_part = 1, natom_plumed
[all …]
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dmetadynamics.F158 natom_plumed = subsys%particles%n_els
260 natom_plumed = subsys%particles%n_els
261 ALLOCATE (pos_plumed_x(natom_plumed))
262 ALLOCATE (pos_plumed_y(natom_plumed))
263 ALLOCATE (pos_plumed_z(natom_plumed))
265 ALLOCATE (force_plumed_x(natom_plumed))
266 ALLOCATE (force_plumed_y(natom_plumed))
267 ALLOCATE (force_plumed_z(natom_plumed))
269 ALLOCATE (mass_plumed(natom_plumed))
275 DO i_part = 1, natom_plumed
[all …]