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Searched refs:vec_dif (Results 1 – 5 of 5) sorted by relevance

/dports/science/drawxtl/DRAWxtl/source/DRAWxtl55/
H A DDRAWxtl_proto.h555 int vec_dif (int n1, float v1[3], int n2, float v2[3], int n3, float v3[3], float v[3]);
H A DRead_Input.cxx3304 vec_dif (int n1, float v1[3], int n2, float v2[3], int n3, float v3[3], float v[3]) in vec_dif() function
H A DImport.cxx826 if (vec_dif in import_cif()
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dcolvar_methods.F4740 REAL(dp), ALLOCATABLE, DIMENSION(:) :: r, r0, vec_dif local
4757 ALLOCATE (vec_dif(rmsd_atom))
4788 vec_dif(iat) = (riat(1, iat) - r(ii + 1))**2 + (riat(2, iat) - r(ii + 2))**2 &
4790 sum_exp = sum_exp + vec_dif(iat)
4832 DEALLOCATE (vec_dif)
5095 REAL(dp), ALLOCATABLE, DIMENSION(:) :: r, r0, s1v, vec_dif local
5111 ALLOCATE (vec_dif(rmsd_atom))
5142 …vec_dif(iat) = (riat(1, iat) - r(ii + 1))**2 + (riat(2, iat) - r(ii + 2))**2 + (riat(3, iat) - r(i…
5143 sum_exp = sum_exp + vec_dif(iat)
5175 DEALLOCATE (vec_dif)
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dcolvar_methods.F4740 REAL(dp), ALLOCATABLE, DIMENSION(:) :: r, r0, vec_dif local
4757 ALLOCATE (vec_dif(rmsd_atom))
4788 vec_dif(iat) = (riat(1, iat) - r(ii + 1))**2 + (riat(2, iat) - r(ii + 2))**2 &
4790 sum_exp = sum_exp + vec_dif(iat)
4832 DEALLOCATE (vec_dif)
5095 REAL(dp), ALLOCATABLE, DIMENSION(:) :: r, r0, s1v, vec_dif local
5111 ALLOCATE (vec_dif(rmsd_atom))
5142 …vec_dif(iat) = (riat(1, iat) - r(ii + 1))**2 + (riat(2, iat) - r(ii + 2))**2 + (riat(3, iat) - r(i…
5143 sum_exp = sum_exp + vec_dif(iat)
5175 DEALLOCATE (vec_dif)