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subroutine | xc_pw_laplace_r3d_rs (pw, pw_pool, deriv_method_id, pw_out, tmp_g) |
| Calculates the Laplacian of pw.
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subroutine | xc_pw_laplace_c1d_gs (pw, pw_pool, deriv_method_id, pw_out, tmp_g) |
| Calculates the Laplacian of pw.
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Definition at line 46 of file xc_util.F.
◆ xc_pw_laplace_r3d_rs()
subroutine xc_util::xc_pw_laplace::xc_pw_laplace_r3d_rs |
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type(pw_r3d_rs_type), intent(inout) |
pw, |
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type(pw_pool_type), intent(in), pointer |
pw_pool, |
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integer, intent(in) |
deriv_method_id, |
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type(pw_r3d_rs_type), intent(inout), optional |
pw_out, |
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type(pw_c1d_gs_type), intent(in), optional |
tmp_g |
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) |
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Calculates the Laplacian of pw.
- Parameters
-
pw | on input: pw of which the Laplacian shall be calculated, on output if pw_out is absent: Laplacian of input |
pw_pool | ... |
deriv_method_id | ... |
pw_out | if present, save the Laplacian of pw here |
tmp_g | scratch grid in reciprocal space, used instead of the internal grid if given explicitly to save memory |
Definition at line 145 of file xc_util.F.
◆ xc_pw_laplace_c1d_gs()
subroutine xc_util::xc_pw_laplace::xc_pw_laplace_c1d_gs |
( |
type(pw_c1d_gs_type), intent(inout) |
pw, |
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type(pw_pool_type), intent(in), pointer |
pw_pool, |
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integer, intent(in) |
deriv_method_id, |
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type(pw_r3d_rs_type), intent(inout), optional |
pw_out, |
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type(pw_c1d_gs_type), intent(in), optional |
tmp_g |
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) |
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Calculates the Laplacian of pw.
- Parameters
-
pw | on input: pw of which the Laplacian shall be calculated, on output if pw_out is absent: Laplacian of input |
pw_pool | ... |
deriv_method_id | ... |
pw_out | if present, save the Laplacian of pw here |
tmp_g | scratch grid in reciprocal space, used instead of the internal grid if given explicitly to save memory |
Definition at line 198 of file xc_util.F.
The documentation for this interface was generated from the following file: