orbitals_base::changehybridcoefficients Interface Reference
Public Member Functions | |
| subroutine | changehybridcoefficients_from_array (hybrid, new_coefs) |
| Changes the coeffiecients of the given hybrid. More... | |
| subroutine | changehybridcoefficients_from_array_ptr (hybrid, new_coefs) |
| Changes the data location of the coeffiecients of the given hybrid. More... | |
| subroutine | changehybridcoefficients_from_vals (hybrid, s, px, py, pz) |
| Changes the coeffiecients of the given hybrid. More... | |
Member Function/Subroutine Documentation
◆ changehybridcoefficients_from_array()
| subroutine orbitals_base::changehybridcoefficients::changehybridcoefficients_from_array | ( | type(orbital), intent(inout), pointer | hybrid, |
| real, dimension(0:3), intent(in) | new_coefs | ||
| ) |
Changes the coeffiecients of the given hybrid.
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◆ changehybridcoefficients_from_array_ptr()
| subroutine orbitals_base::changehybridcoefficients::changehybridcoefficients_from_array_ptr | ( | type(orbital), intent(inout), pointer | hybrid, |
| type(real_ptr), dimension(0:3), intent(in) | new_coefs | ||
| ) |
Changes the data location of the coeffiecients of the given hybrid.
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◆ changehybridcoefficients_from_vals()
| subroutine orbitals_base::changehybridcoefficients::changehybridcoefficients_from_vals | ( | type(orbital), intent(inout), pointer | hybrid, |
| real, intent(in) | s, | ||
| real, intent(in) | px, | ||
| real, intent(in) | py, | ||
| real, intent(in) | pz | ||
| ) |
Changes the coeffiecients of the given hybrid.
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The documentation for this interface was generated from the following file:
