fist_nonbond_env_types::allegro_data_type Type Reference

Data Fields
integer, dimension(:), pointer	use_indices => NULL()
real(kind=dp), dimension(:, :), pointer	force => NULL()
real(kind=dp), dimension(3, 3)	virial = 0.0_dp
type(torch_model_type)	model

Detailed Description

Definition at line 66 of file fist_nonbond_env_types.F.

Field Documentation

use_indices

integer, dimension(:), pointer fist_nonbond_env_types::allegro_data_type::use_indices => NULL()

Definition at line 67 of file fist_nonbond_env_types.F.

force

real(kind=dp), dimension(:, :), pointer fist_nonbond_env_types::allegro_data_type::force => NULL()

Definition at line 68 of file fist_nonbond_env_types.F.

virial

real(kind=dp), dimension(3, 3) fist_nonbond_env_types::allegro_data_type::virial = 0.0_dp

Definition at line 69 of file fist_nonbond_env_types.F.

model

type(torch_model_type) fist_nonbond_env_types::allegro_data_type::model

Definition at line 70 of file fist_nonbond_env_types.F.

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The documentation for this type was generated from the following file:

• fist_nonbond_env_types.F