1 |
tim |
378 |
subroutine newLJtype(c_ident, sigma, epsilon, soft_pot, status) |
2 |
gezelter |
264 |
use lj, ONLY : module_newLJtype => newLJtype |
3 |
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integer, parameter :: DP = selected_real_kind(15) |
4 |
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integer,intent(inout) :: c_ident |
5 |
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real(kind=dp),intent(inout) :: sigma |
6 |
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real(kind=dp),intent(inout) :: epsilon |
7 |
tim |
378 |
integer,intent(inout) :: soft_pot |
8 |
gezelter |
264 |
integer,intent(inout) :: status |
9 |
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10 |
tim |
378 |
call module_newLJtype(c_ident, sigma, epsilon, soft_pot, status) |
11 |
gezelter |
264 |
|
12 |
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end subroutine newLJtype |
13 |
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14 |
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subroutine useGeometricMixing() |
15 |
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use lj, ONLY: module_useGeometricMixing => useGeometricMixing |
16 |
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17 |
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call module_useGeometricMixing() |
18 |
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return |
19 |
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end subroutine useGeometricMixing |
20 |
chuckv |
492 |
|
21 |
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subroutine destroyLJTypes() |
22 |
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use lj, ONLY: module_destroyLJTypes => destroyLJTypes |
23 |
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24 |
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call module_destroyLJTypes() |
25 |
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26 |
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end subroutine destroyLJTypes |