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Contents
Index
Module
dynamicalsystem_module
in file DynamicalSystem.f95
Subsections
Purpose
Usage
Uses
Module variables
Type
DynamicalSystem
Elements
Interface
assignment(=)
Interface
add_atoms
Interface
remove_atoms
Interface
write_binary
Interface
read_binary
Interface
print
Interface
initialise
Interface
finalise
Interface
kinetic_energy
Interface
angular_momentum
Interface
momentum
Interface
add_thermostat
Subroutine
ds_free_groups
Subroutine
ds_save_state
Subroutine
ds_restore_state
Subroutine
add_group_members
Subroutine
enable_damping
Subroutine
disable_damping
Subroutine
add_heat
Subroutine
rescale_velo
Subroutine
reinitialise_velo_normal
Subroutine
zero_momentum
Subroutine
zero_angular_momentum
Subroutine
advance_verlet1
Subroutine
advance_verlet2
Subroutine
advance_verlet
Subroutine
constrain_bond
Subroutine
constrain_bond_diff
Subroutine
ds_add_constraint
Subroutine
ds_amend_constraint
Subroutine
distance_relative_velocity
Subroutine
fix_atoms
Function
atom_type
Function
moment_of_inertia
Function
moment_of_inertia_tensor
Function
torque
Function
temperature
Function
gaussian_velocity_component
Function
gaussian_velocity
Function
centre_of_mass_velo
Function
centre_of_mass_acc
Function
degrees_of_freedom
gabor 2009-06-30
