| /dports/science/lammps/lammps-stable_29Sep2021/lib/atc/ |
| H A D | CbLjCut.h | 21 CbLjCut(double eps, double sig, double cutoff_radius) in CbLjCut()
29 double cutoff_radius() const { return rcut; } in cutoff_radius() function
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| H A D | CbLjSmoothLinear.h | 21 CbLjSmoothLinear(double eps, double sig, double cutoff_radius) in CbLjSmoothLinear()
34 double cutoff_radius() const { return rcut; } in cutoff_radius() function
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| H A D | CbEam.h | 46 double cutoff_radius() const { return *cutmax; } in cutoff_radius() function
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| /dports/science/liggghts/LIGGGHTS-PUBLIC-3.8.0-26-g6e873439/lib/atc/ |
| H A D | CbLjCut.h | 21 CbLjCut(double eps, double sig, double cutoff_radius) in CbLjCut()
29 double cutoff_radius() const { return rcut; } in cutoff_radius() function
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| H A D | CbLjSmoothLinear.h | 21 CbLjSmoothLinear(double eps, double sig, double cutoff_radius) in CbLjSmoothLinear()
34 double cutoff_radius() const { return rcut; } in cutoff_radius() function
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| H A D | CbEam.h | 46 double cutoff_radius() const { return *cutmax; } in cutoff_radius() function
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| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/pw/ |
| H A D | dg_rho0_types.F | 46 REAL(KIND=dp) :: cutoff_radius component
66 SUBROUTINE dg_rho0_set(dg_rho0, TYPE, grid, kind, cutoff_radius, & argument
71 REAL(KIND=dp), OPTIONAL :: cutoff_radius local
99 SUBROUTINE dg_rho0_get(dg_rho0, cutoff_radius, TYPE, grid, kind, gcc, zet, density) argument
101 REAL(KIND=dp), OPTIONAL :: cutoff_radius local
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| H A D | dgs.F | 92 SUBROUTINE dg_pme_grid_setup(b_cell_hmat, npts_s, cutoff_radius, grid_s, grid_b, & argument
97 REAL(KIND=dp), INTENT(IN) :: cutoff_radius local
160 SUBROUTINE dg_find_cutoff(b_cell_hmat, npts_s, cutoff_radius, grid_s, & argument
165 REAL(KIND=dp), INTENT(IN) :: cutoff_radius local
229 SUBROUTINE dg_get_spacing(npts, cutoff_radius, dr) argument
232 REAL(KIND=dp), INTENT(IN) :: cutoff_radius local
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| /dports/science/cp2k-data/cp2k-7.1.0/src/pw/ |
| H A D | dg_rho0_types.F | 46 REAL(KIND=dp) :: cutoff_radius component
66 SUBROUTINE dg_rho0_set(dg_rho0, TYPE, grid, kind, cutoff_radius, & argument
71 REAL(KIND=dp), OPTIONAL :: cutoff_radius local
99 SUBROUTINE dg_rho0_get(dg_rho0, cutoff_radius, TYPE, grid, kind, gcc, zet, density) argument
102 REAL(KIND=dp), OPTIONAL :: cutoff_radius local
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| H A D | dgs.F | 92 SUBROUTINE dg_pme_grid_setup(b_cell_hmat, npts_s, cutoff_radius, grid_s, grid_b, & argument
97 REAL(KIND=dp), INTENT(IN) :: cutoff_radius local
160 SUBROUTINE dg_find_cutoff(b_cell_hmat, npts_s, cutoff_radius, grid_s, & argument
165 REAL(KIND=dp), INTENT(IN) :: cutoff_radius local
229 SUBROUTINE dg_get_spacing(npts, cutoff_radius, dr) argument
232 REAL(KIND=dp), INTENT(IN) :: cutoff_radius local
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| /dports/science/qmcpack/qmcpack-3.11.0/src/Numerics/ |
| H A D | OptimizableFunctorBase.h | 53 real_type cutoff_radius = 0.0; member
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| /dports/science/py-phonopy/phonopy-2.11.0/phonopy/harmonic/ |
| H A D | force_constants.py | 132 cutoff_radius, argument
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| /dports/science/phonopy/phonopy-2.11.0/phonopy/harmonic/ |
| H A D | force_constants.py | 132 cutoff_radius, argument
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| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | qs_active_space_types.F | 52 REAL(KIND=dp) :: cutoff_radius component
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| H A D | ewald_pw_types.F | 179 … REAL(KIND=dp) :: alpha, alphasq, cutoff_radius, epsilon, & local
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| H A D | hfx_admm_utils.F | 802 REAL(dp) :: cutoff_radius, hfx_fraction, omega, & local
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| H A D | libint_2c_3c.F | 62 REAL(dp) :: cutoff_radius !TC cutoff/effective SR range component
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | qs_active_space_types.F | 52 REAL(KIND=dp) :: cutoff_radius component
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| H A D | ewald_pw_types.F | 179 … REAL(KIND=dp) :: alpha, alphasq, cutoff_radius, epsilon, & local
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| H A D | hfx_admm_utils.F | 625 REAL(dp) :: cutoff_radius, hfx_fraction, omega, & local
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| H A D | libint_2c_3c.F | 62 REAL(dp) :: cutoff_radius !TC cutoff/effective SR range component
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| /dports/science/qmcpack/qmcpack-3.11.0/src/QMCWaveFunctions/ |
| H A D | EinsplineSetBuilderESHDF.fft.cpp | 241 RealType cutoff_radius, polynomial_radius, spline_radius; in ReadOrbitalInfo_ESHDF() local
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| /dports/science/madness/madness-ebb3fd7/src/examples/ |
| H A D | smooth.h | 54 static double cutoff_radius = 5.0; variable
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| /dports/science/py-phonopy/phonopy-2.11.0/phonopy/ |
| H A D | api_phonopy.py | 590 def set_force_constants_zero_with_radius(self, cutoff_radius): argument
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| /dports/science/phonopy/phonopy-2.11.0/phonopy/ |
| H A D | api_phonopy.py | 590 def set_force_constants_zero_with_radius(self, cutoff_radius): argument
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