Searched refs:rxnew (Results 1 – 4 of 4) sorted by relevance
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/motion/mc/ |
H A D | mc_coordinates.F | 639 REAL(KIND=dp) :: cosdg, dgamma, rand, rx, rxnew, ry, & local 677 rxnew = cosdg*rx + sindg*rz 680 r(1, iunit) = rxnew + center_of_mass(1) 690 rxnew = cosdg*rx + sindg*ry 693 r(1, iunit) = rxnew + center_of_mass(1)
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H A D | mc_moves.F | 678 exp_min_val, masstot, nxcm, nycm, nzcm, rand, rx, rxnew, ry, rynew, rz, rznew, sindg, & local 830 rxnew = cosdg*rx + sindg*rz 833 particles%els(iunit)%r(1) = rxnew + nxcm 846 rxnew = cosdg*rx - sindg*ry 849 particles%els(iunit)%r(1) = rxnew + nxcm
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/dports/science/cp2k-data/cp2k-7.1.0/src/motion/mc/ |
H A D | mc_coordinates.F | 640 REAL(KIND=dp) :: cosdg, dgamma, rand, rx, rxnew, ry, & local 678 rxnew = cosdg*rx + sindg*rz 681 r(1, iunit) = rxnew + center_of_mass(1) 691 rxnew = cosdg*rx + sindg*ry 694 r(1, iunit) = rxnew + center_of_mass(1)
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H A D | mc_moves.F | 679 exp_min_val, masstot, nxcm, nycm, nzcm, rand, rx, rxnew, ry, rynew, rz, rznew, sindg, & local 831 rxnew = cosdg*rx + sindg*rz 834 particles%els(iunit)%r(1) = rxnew + nxcm 847 rxnew = cosdg*rx - sindg*ry 850 particles%els(iunit)%r(1) = rxnew + nxcm
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