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| pure real(kind=real64) function, dimension(3) | dcdfort_utils::pbc (a, box) |
| | Corrects for the periodic boundary condition. More...
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| pure real(kind=real64) function, dimension(3) | dcdfort_utils::cross (a, b) |
| | Performs cross product between two vectors. More...
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| pure real(kind=real64) function | dcdfort_utils::distance2 (a, b, box) |
| | Calculates the distance squared between two points. More...
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| pure real(kind=real64) function | dcdfort_utils::distance (a, b, box) |
| | Calculates the distance between two points. More...
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| pure real(kind=real64) function, dimension(3) | dcdfort_utils::bond_vector (a, b, box) |
| | Calculates the bond vector between two points. More...
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| pure real(kind=real64) function | dcdfort_utils::magnitude (a) |
| | Calculates the magnitude of a vector. More...
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| pure real(kind=real64) function | dcdfort_utils::bond_angle (a, b, c, box) |
| | Calculates the bond angle between two vectors. More...
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| pure real(kind=real64) function | dcdfort_utils::dihedral_angle (i, j, k, l, box) |
| | Calculates the dihedral angle between two planes formed by four atoms. More...
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