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helium_nnp Module Reference

Methods dealing with Neural Network interaction potential. More...

Functions/Subroutines

subroutine, public helium_init_nnp (helium, nnp, input)
 Read and initialize all the information for neural network potentials.
subroutine, public helium_nnp_print (nnp, print_section, ind_he)
 Print properties according to the requests in input file.

Detailed Description

Methods dealing with Neural Network interaction potential.

Author
Laura Duran
Date
2023-02-17

Function/Subroutine Documentation

◆ helium_init_nnp()

subroutine, public helium_nnp::helium_init_nnp ( type(helium_solvent_type), intent(inout) helium,
type(nnp_type), pointer nnp,
type(section_vals_type), pointer input )

Read and initialize all the information for neural network potentials.

Parameters
helium...
nnp...
input...
Date
2023-02-21
Author
lduran

Definition at line 67 of file helium_nnp.F.

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◆ helium_nnp_print()

subroutine, public helium_nnp::helium_nnp_print ( type(nnp_type), intent(inout) nnp,
type(section_vals_type), intent(in), pointer print_section,
integer, intent(in) ind_he )

Print properties according to the requests in input file.

Parameters
nnp...
print_section...
ind_he...
Date
2023-07-31
Author
Laura Duran

Definition at line 167 of file helium_nnp.F.

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