remove superfluous variables
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@ -16,107 +16,91 @@ module plastic_disloUCLA
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implicit none
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private
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integer(pInt), dimension(:), allocatable, public, protected :: &
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plastic_disloUCLA_sizePostResults !< cumulative size of post results
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plastic_disloUCLA_sizePostResults !< cumulative size of post results
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integer(pInt), dimension(:,:), allocatable, target, public :: &
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plastic_disloUCLA_sizePostResult !< size of each post result output
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plastic_disloUCLA_sizePostResult !< size of each post result output
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character(len=64), dimension(:,:), allocatable, target, public :: &
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plastic_disloUCLA_output !< name of each post result output
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character(len=12), dimension(3), parameter, private :: &
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plastic_disloUCLA_listBasicSlipStates = &
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['rhoEdge ', 'rhoEdgeDip ', 'accshearslip']
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character(len=12), dimension(2), parameter, private :: &
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plastic_disloUCLA_listBasicTwinStates = &
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['twinFraction', 'accsheartwin']
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character(len=17), dimension(4), parameter, private :: &
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plastic_disloUCLA_listDependentSlipStates = &
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['invLambdaSlip ', 'invLambdaSlipTwin', 'meanFreePathSlip ', 'tauSlipThreshold ']
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character(len=16), dimension(4), parameter, private :: &
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plastic_disloUCLA_listDependentTwinStates = &
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['invLambdaTwin ', 'meanFreePathTwin', 'tauTwinThreshold', 'twinVolume ']
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plastic_disloUCLA_output !< name of each post result output
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real(pReal), parameter, private :: &
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kB = 1.38e-23_pReal !< Boltzmann constant in J/Kelvin
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kB = 1.38e-23_pReal !< Boltzmann constant in J/Kelvin
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integer(pInt), dimension(:), allocatable, target, public :: &
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plastic_disloUCLA_Noutput !< number of outputs per instance of this plasticity
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plastic_disloUCLA_Noutput !< number of outputs per instance of this plasticity
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integer(pInt), dimension(:), allocatable, public, protected :: &
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plastic_disloUCLA_totalNslip, & !< total number of active slip systems for each instance
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plastic_disloUCLA_totalNtwin !< total number of active twin systems for each instance
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integer(pInt), dimension(:), allocatable, private :: &
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plastic_disloUCLA_totalNslip, & !< total number of active slip systems for each instance
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plastic_disloUCLA_totalNtwin !< total number of active twin systems for each instance
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integer(pInt), dimension(:,:), allocatable, private :: &
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plastic_disloUCLA_Nslip, & !< number of active slip systems for each family and instance
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plastic_disloUCLA_Ntwin !< number of active twin systems for each family and instance
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plastic_disloUCLA_Nslip, & !< number of active slip systems for each family and instance
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plastic_disloUCLA_Ntwin !< number of active twin systems for each family and instance
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real(pReal), dimension(:), allocatable, private :: &
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plastic_disloUCLA_CAtomicVolume, & !< atomic volume in Bugers vector unit
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plastic_disloUCLA_D0, & !< prefactor for self-diffusion coefficient
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plastic_disloUCLA_Qsd, & !< activation energy for dislocation climb
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plastic_disloUCLA_GrainSize, & !< grain size
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plastic_disloUCLA_MaxTwinFraction, & !< maximum allowed total twin volume fraction
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plastic_disloUCLA_CEdgeDipMinDistance, & !<
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plastic_disloUCLA_Cmfptwin, & !<
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plastic_disloUCLA_Cthresholdtwin, & !<
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plastic_disloUCLA_SolidSolutionStrength, & !< Strength due to elements in solid solution
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plastic_disloUCLA_L0, & !< Length of twin nuclei in Burgers vectors
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plastic_disloUCLA_xc, & !< critical distance for formation of twin nucleus
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plastic_disloUCLA_VcrossSlip, & !< cross slip volume
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plastic_disloUCLA_SFE_0K, & !< stacking fault energy at zero K
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plastic_disloUCLA_dSFE_dT, & !< temperature dependance of stacking fault energy
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plastic_disloUCLA_dipoleFormationFactor, & !< scaling factor for dipole formation: 0: off, 1: on. other values not useful
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plastic_disloUCLA_aTolRho, & !< absolute tolerance for integration of dislocation density
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plastic_disloUCLA_aTolTwinFrac !< absolute tolerance for integration of twin volume fraction
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plastic_disloUCLA_CAtomicVolume, & !< atomic volume in Bugers vector unit
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plastic_disloUCLA_D0, & !< prefactor for self-diffusion coefficient
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plastic_disloUCLA_Qsd, & !< activation energy for dislocation climb
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plastic_disloUCLA_GrainSize, & !< grain size
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plastic_disloUCLA_MaxTwinFraction, & !< maximum allowed total twin volume fraction
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plastic_disloUCLA_CEdgeDipMinDistance, & !<
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plastic_disloUCLA_Cmfptwin, & !<
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plastic_disloUCLA_Cthresholdtwin, & !<
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plastic_disloUCLA_SolidSolutionStrength, & !< Strength due to elements in solid solution
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plastic_disloUCLA_L0, & !< Length of twin nuclei in Burgers vectors
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plastic_disloUCLA_xc, & !< critical distance for formation of twin nucleus
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plastic_disloUCLA_VcrossSlip, & !< cross slip volume
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plastic_disloUCLA_SFE_0K, & !< stacking fault energy at zero K
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plastic_disloUCLA_dSFE_dT, & !< temperature dependance of stacking fault energy
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plastic_disloUCLA_dipoleFormationFactor, & !< scaling factor for dipole formation: 0: off, 1: on. other values not useful
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plastic_disloUCLA_aTolRho, & !< absolute tolerance for integration of dislocation density
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plastic_disloUCLA_aTolTwinFrac !< absolute tolerance for integration of twin volume fraction
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real(pReal), dimension(:,:,:,:), allocatable, private :: &
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plastic_disloUCLA_Ctwin66 !< twin elasticity matrix in Mandel notation for each instance
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plastic_disloUCLA_Ctwin66 !< twin elasticity matrix in Mandel notation for each instance
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real(pReal), dimension(:,:,:,:,:,:), allocatable, private :: &
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plastic_disloUCLA_Ctwin3333 !< twin elasticity matrix for each instance
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plastic_disloUCLA_Ctwin3333 !< twin elasticity matrix for each instance
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real(pReal), dimension(:,:), allocatable, private :: &
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plastic_disloUCLA_rhoEdge0, & !< initial edge dislocation density per slip system for each family and instance
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plastic_disloUCLA_rhoEdgeDip0, & !< initial edge dipole density per slip system for each family and instance
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plastic_disloUCLA_burgersPerSlipFamily, & !< absolute length of burgers vector [m] for each slip family and instance
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plastic_disloUCLA_burgersPerSlipSystem, & !< absolute length of burgers vector [m] for each slip system and instance
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plastic_disloUCLA_burgersPerTwinFamily, & !< absolute length of burgers vector [m] for each twin family and instance
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plastic_disloUCLA_burgersPerTwinSystem, & !< absolute length of burgers vector [m] for each twin system and instance
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plastic_disloUCLA_QedgePerSlipFamily, & !< activation energy for glide [J] for each slip family and instance
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plastic_disloUCLA_QedgePerSlipSystem, & !< activation energy for glide [J] for each slip system and instance
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plastic_disloUCLA_v0PerSlipFamily, & !< dislocation velocity prefactor [m/s] for each family and instance
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plastic_disloUCLA_v0PerSlipSystem, & !< dislocation velocity prefactor [m/s] for each slip system and instance
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plastic_disloUCLA_tau_peierlsPerSlipFamily, & !< Peierls stress [Pa] for each family and instance
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plastic_disloUCLA_Ndot0PerTwinFamily, & !< twin nucleation rate [1/m³s] for each twin family and instance
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plastic_disloUCLA_Ndot0PerTwinSystem, & !< twin nucleation rate [1/m³s] for each twin system and instance
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plastic_disloUCLA_tau_r, & !< stress to bring partial close together for each twin system and instance
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plastic_disloUCLA_twinsizePerTwinFamily, & !< twin thickness [m] for each twin family and instance
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plastic_disloUCLA_twinsizePerTwinSystem, & !< twin thickness [m] for each twin system and instance
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plastic_disloUCLA_CLambdaSlipPerSlipFamily, & !< Adj. parameter for distance between 2 forest dislocations for each slip family and instance
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plastic_disloUCLA_CLambdaSlipPerSlipSystem, & !< Adj. parameter for distance between 2 forest dislocations for each slip system and instance
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plastic_disloUCLA_interaction_SlipSlip, & !< coefficients for slip-slip interaction for each interaction type and instance
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plastic_disloUCLA_interaction_SlipTwin, & !< coefficients for slip-twin interaction for each interaction type and instance
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plastic_disloUCLA_interaction_TwinSlip, & !< coefficients for twin-slip interaction for each interaction type and instance
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plastic_disloUCLA_interaction_TwinTwin, & !< coefficients for twin-twin interaction for each interaction type and instance
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plastic_disloUCLA_pPerSlipFamily, & !< p-exponent in glide velocity
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plastic_disloUCLA_qPerSlipFamily, & !< q-exponent in glide velocity
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plastic_disloUCLA_rhoEdge0, & !< initial edge dislocation density per slip system for each family and instance
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plastic_disloUCLA_rhoEdgeDip0, & !< initial edge dipole density per slip system for each family and instance
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plastic_disloUCLA_burgersPerSlipFamily, & !< absolute length of burgers vector [m] for each slip family and instance
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plastic_disloUCLA_burgersPerSlipSystem, & !< absolute length of burgers vector [m] for each slip system and instance
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plastic_disloUCLA_burgersPerTwinFamily, & !< absolute length of burgers vector [m] for each twin family and instance
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plastic_disloUCLA_burgersPerTwinSystem, & !< absolute length of burgers vector [m] for each twin system and instance
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plastic_disloUCLA_QedgePerSlipFamily, & !< activation energy for glide [J] for each slip family and instance
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plastic_disloUCLA_QedgePerSlipSystem, & !< activation energy for glide [J] for each slip system and instance
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plastic_disloUCLA_v0PerSlipFamily, & !< dislocation velocity prefactor [m/s] for each family and instance
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plastic_disloUCLA_v0PerSlipSystem, & !< dislocation velocity prefactor [m/s] for each slip system and instance
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plastic_disloUCLA_tau_peierlsPerSlipFamily, & !< Peierls stress [Pa] for each family and instance
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plastic_disloUCLA_Ndot0PerTwinFamily, & !< twin nucleation rate [1/m³s] for each twin family and instance
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plastic_disloUCLA_Ndot0PerTwinSystem, & !< twin nucleation rate [1/m³s] for each twin system and instance
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plastic_disloUCLA_tau_r, & !< stress to bring partial close together for each twin system and instance
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plastic_disloUCLA_twinsizePerTwinFamily, & !< twin thickness [m] for each twin family and instance
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plastic_disloUCLA_twinsizePerTwinSystem, & !< twin thickness [m] for each twin system and instance
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plastic_disloUCLA_CLambdaSlipPerSlipFamily, & !< Adj. parameter for distance between 2 forest dislocations for each slip family and instance
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plastic_disloUCLA_CLambdaSlipPerSlipSystem, & !< Adj. parameter for distance between 2 forest dislocations for each slip system and instance
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plastic_disloUCLA_interaction_SlipSlip, & !< coefficients for slip-slip interaction for each interaction type and instance
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plastic_disloUCLA_interaction_SlipTwin, & !< coefficients for slip-twin interaction for each interaction type and instance
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plastic_disloUCLA_interaction_TwinSlip, & !< coefficients for twin-slip interaction for each interaction type and instance
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plastic_disloUCLA_interaction_TwinTwin, & !< coefficients for twin-twin interaction for each interaction type and instance
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plastic_disloUCLA_pPerSlipFamily, & !< p-exponent in glide velocity
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plastic_disloUCLA_qPerSlipFamily, & !< q-exponent in glide velocity
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!* mobility law parameters
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plastic_disloUCLA_kinkheight, & !< height of the kink pair
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plastic_disloUCLA_omega, & !< attempt frequency for kink pair nucleation
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plastic_disloUCLA_kinkwidth, & !< width of the kink pair
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plastic_disloUCLA_dislolength, & !< dislocation length (lamda)
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plastic_disloUCLA_friction, & !< friction coeff. B (kMC)
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plastic_disloUCLA_kinkheight, & !< height of the kink pair
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plastic_disloUCLA_omega, & !< attempt frequency for kink pair nucleation
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plastic_disloUCLA_kinkwidth, & !< width of the kink pair
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plastic_disloUCLA_dislolength, & !< dislocation length (lamda)
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plastic_disloUCLA_friction, & !< friction coeff. B (kMC)
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!*
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plastic_disloUCLA_rPerTwinFamily, & !< r-exponent in twin nucleation rate
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plastic_disloUCLA_nonSchmidCoeff !< non-Schmid coefficients (bcc)
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plastic_disloUCLA_rPerTwinFamily, & !< r-exponent in twin nucleation rate
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plastic_disloUCLA_nonSchmidCoeff !< non-Schmid coefficients (bcc)
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real(pReal), dimension(:,:,:), allocatable, private :: &
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plastic_disloUCLA_interactionMatrix_SlipSlip, & !< interaction matrix of the different slip systems for each instance
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plastic_disloUCLA_interactionMatrix_SlipTwin, & !< interaction matrix of slip systems with twin systems for each instance
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plastic_disloUCLA_interactionMatrix_TwinSlip, & !< interaction matrix of twin systems with slip systems for each instance
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plastic_disloUCLA_interactionMatrix_TwinTwin, & !< interaction matrix of the different twin systems for each instance
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plastic_disloUCLA_forestProjectionEdge !< matrix of forest projections of edge dislocations for each instance
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plastic_disloUCLA_interactionMatrix_SlipSlip, & !< interaction matrix of the different slip systems for each instance
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plastic_disloUCLA_interactionMatrix_SlipTwin, & !< interaction matrix of slip systems with twin systems for each instance
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plastic_disloUCLA_interactionMatrix_TwinSlip, & !< interaction matrix of twin systems with slip systems for each instance
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plastic_disloUCLA_interactionMatrix_TwinTwin, & !< interaction matrix of the different twin systems for each instance
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plastic_disloUCLA_forestProjectionEdge !< matrix of forest projections of edge dislocations for each instance
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enum, bind(c)
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enumerator :: undefined_ID, &
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@ -137,7 +121,7 @@ module plastic_disloUCLA
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threshold_stress_twin_ID
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end enum
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integer(kind(undefined_ID)), dimension(:,:), allocatable, private :: &
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plastic_disloUCLA_outputID !< ID of each post result output
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plastic_disloUCLA_outputID !< ID of each post result output
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type, private :: tDisloUCLAState
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real(pReal), pointer, dimension(:,:) :: &
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@ -697,16 +681,19 @@ subroutine plastic_disloUCLA_init(fileUnit)
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plastic_disloUCLA_sizePostResults(instance) = plastic_disloUCLA_sizePostResults(instance) + mySize
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endif
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enddo outputs
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!--------------------------------------------------------------------------------------------------
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! allocate state arrays
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sizeDotState = int(size(plastic_disloUCLA_listBasicSlipStates),pInt) * ns &
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+ int(size(plastic_disloUCLA_listBasicTwinStates),pInt) * nt
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sizeDeltaState = 0_pInt
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sizeState = sizeDotState &
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+ int(size(plastic_disloUCLA_listDependentSlipStates),pInt) * ns &
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+ int(size(plastic_disloUCLA_listDependentTwinStates),pInt) * nt
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sizeDotState = int(size(['rhoEdge ','rhoEdgeDip ','accshearslip']),pInt) * ns &
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+ int(size(['twinFraction','accsheartwin']),pInt) * nt
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sizeDeltaState = 0_pInt
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sizeState = sizeDotState &
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+ int(size(['invLambdaSlip ','invLambdaSlipTwin ',&
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'meanFreePathSlip ','tauSlipThreshold ']),pInt) * ns &
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+ int(size(['invLambdaTwin ','meanFreePathTwin','tauTwinThreshold',&
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'twinVolume ']),pInt) * nt
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plasticState(phase)%sizeState = sizeState
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plasticState(phase)%sizeDotState = sizeDotState
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plasticState(phase)%sizeDeltaState = sizeDeltaState
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@ -848,78 +835,78 @@ subroutine plastic_disloUCLA_init(fileUnit)
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enddo otherTwinSystems2; enddo otherTwinFamilies2
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enddo myTwinSystems
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enddo myTwinFamilies
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startIndex=1_pInt
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endIndex=ns
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state(instance)%rhoEdge=>plasticState(phase)%state(startIndex:endIndex,:)
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state0(instance)%rhoEdge=>plasticState(phase)%state0(startIndex:endIndex,:)
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dotState(instance)%rhoEdge=>plasticState(phase)%dotState(startIndex:endIndex,:)
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startIndex=endIndex+1_pInt
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endIndex=endIndex+ns
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state(instance)%rhoEdgeDip=>plasticState(phase)%state(startIndex:endIndex,:)
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state0(instance)%rhoEdgeDip=>plasticState(phase)%state0(startIndex:endIndex,:)
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dotState(instance)%rhoEdgeDip=>plasticState(phase)%dotState(startIndex:endIndex,:)
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startIndex=endIndex+1_pInt
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endIndex=endIndex+ns
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state(instance)%accshear_slip=>plasticState(phase)%state(startIndex:endIndex,:)
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state0(instance)%accshear_slip=>plasticState(phase)%state0(startIndex:endIndex,:)
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dotState(instance)%accshear_slip=>plasticState(phase)%dotState(startIndex:endIndex,:)
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startIndex=endIndex+1_pInt
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endIndex=endIndex+nt
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state(instance)%twinFraction=>plasticState(phase)%state(startIndex:endIndex,:)
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state0(instance)%twinFraction=>plasticState(phase)%state0(startIndex:endIndex,:)
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dotState(instance)%twinFraction=>plasticState(phase)%dotState(startIndex:endIndex,:)
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startIndex=endIndex+1_pInt
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endIndex=endIndex+nt
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state(instance)%accshear_twin=>plasticState(phase)%state(startIndex:endIndex,:)
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state0(instance)%accshear_twin=>plasticState(phase)%state0(startIndex:endIndex,:)
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dotState(instance)%accshear_twin=>plasticState(phase)%dotState(startIndex:endIndex,:)
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startIndex=endIndex+1_pInt
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endIndex=endIndex+ns
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state(instance)%invLambdaSlip=>plasticState(phase)%state(startIndex:endIndex,:)
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state0(instance)%invLambdaSlip=>plasticState(phase)%state0(startIndex:endIndex,:)
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startIndex=endIndex+1
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endIndex=endIndex+ns
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state(instance)%invLambdaSlipTwin=>plasticState(phase)%state(startIndex:endIndex,:)
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state0(instance)%invLambdaSlipTwin=>plasticState(phase)%state0(startIndex:endIndex,:)
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startIndex=endIndex+1
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endIndex=endIndex+nt
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state(instance)%invLambdaTwin=>plasticState(phase)%state(startIndex:endIndex,:)
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state0(instance)%invLambdaTwin=>plasticState(phase)%state0(startIndex:endIndex,:)
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startIndex=endIndex+1
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endIndex=endIndex+ns
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state(instance)%mfp_slip=>plasticState(phase)%state(startIndex:endIndex,:)
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state0(instance)%mfp_slip=>plasticState(phase)%state0(startIndex:endIndex,:)
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startIndex=endIndex+1
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endIndex=endIndex+nt
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state(instance)%mfp_twin=>plasticState(phase)%state(startIndex:endIndex,:)
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state0(instance)%mfp_twin=>plasticState(phase)%state0(startIndex:endIndex,:)
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startIndex=endIndex+1
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endIndex=endIndex+ns
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state(instance)%threshold_stress_slip=>plasticState(phase)%state(startIndex:endIndex,:)
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state0(instance)%threshold_stress_slip=>plasticState(phase)%state0(startIndex:endIndex,:)
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enddo myTwinFamilies
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startIndex=1_pInt
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endIndex=ns
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state(instance)%rhoEdge=>plasticState(phase)%state(startIndex:endIndex,:)
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state0(instance)%rhoEdge=>plasticState(phase)%state0(startIndex:endIndex,:)
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dotState(instance)%rhoEdge=>plasticState(phase)%dotState(startIndex:endIndex,:)
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startIndex=endIndex+1_pInt
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endIndex=endIndex+ns
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state(instance)%rhoEdgeDip=>plasticState(phase)%state(startIndex:endIndex,:)
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state0(instance)%rhoEdgeDip=>plasticState(phase)%state0(startIndex:endIndex,:)
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dotState(instance)%rhoEdgeDip=>plasticState(phase)%dotState(startIndex:endIndex,:)
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startIndex=endIndex+1_pInt
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endIndex=endIndex+ns
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state(instance)%accshear_slip=>plasticState(phase)%state(startIndex:endIndex,:)
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state0(instance)%accshear_slip=>plasticState(phase)%state0(startIndex:endIndex,:)
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dotState(instance)%accshear_slip=>plasticState(phase)%dotState(startIndex:endIndex,:)
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startIndex=endIndex+1_pInt
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endIndex=endIndex+nt
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state(instance)%twinFraction=>plasticState(phase)%state(startIndex:endIndex,:)
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state0(instance)%twinFraction=>plasticState(phase)%state0(startIndex:endIndex,:)
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dotState(instance)%twinFraction=>plasticState(phase)%dotState(startIndex:endIndex,:)
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startIndex=endIndex+1_pInt
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endIndex=endIndex+nt
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state(instance)%accshear_twin=>plasticState(phase)%state(startIndex:endIndex,:)
|
||||
state0(instance)%accshear_twin=>plasticState(phase)%state0(startIndex:endIndex,:)
|
||||
dotState(instance)%accshear_twin=>plasticState(phase)%dotState(startIndex:endIndex,:)
|
||||
|
||||
startIndex=endIndex+1_pInt
|
||||
endIndex=endIndex+ns
|
||||
state(instance)%invLambdaSlip=>plasticState(phase)%state(startIndex:endIndex,:)
|
||||
state0(instance)%invLambdaSlip=>plasticState(phase)%state0(startIndex:endIndex,:)
|
||||
|
||||
startIndex=endIndex+1
|
||||
endIndex=endIndex+ns
|
||||
state(instance)%invLambdaSlipTwin=>plasticState(phase)%state(startIndex:endIndex,:)
|
||||
state0(instance)%invLambdaSlipTwin=>plasticState(phase)%state0(startIndex:endIndex,:)
|
||||
|
||||
startIndex=endIndex+1
|
||||
endIndex=endIndex+nt
|
||||
state(instance)%invLambdaTwin=>plasticState(phase)%state(startIndex:endIndex,:)
|
||||
state0(instance)%invLambdaTwin=>plasticState(phase)%state0(startIndex:endIndex,:)
|
||||
|
||||
startIndex=endIndex+1
|
||||
endIndex=endIndex+ns
|
||||
state(instance)%mfp_slip=>plasticState(phase)%state(startIndex:endIndex,:)
|
||||
state0(instance)%mfp_slip=>plasticState(phase)%state0(startIndex:endIndex,:)
|
||||
|
||||
startIndex=endIndex+1
|
||||
endIndex=endIndex+nt
|
||||
state(instance)%mfp_twin=>plasticState(phase)%state(startIndex:endIndex,:)
|
||||
state0(instance)%mfp_twin=>plasticState(phase)%state0(startIndex:endIndex,:)
|
||||
|
||||
startIndex=endIndex+1
|
||||
endIndex=endIndex+ns
|
||||
state(instance)%threshold_stress_slip=>plasticState(phase)%state(startIndex:endIndex,:)
|
||||
state0(instance)%threshold_stress_slip=>plasticState(phase)%state0(startIndex:endIndex,:)
|
||||
|
||||
startIndex=endIndex+1
|
||||
endIndex=endIndex+nt
|
||||
state(instance)%threshold_stress_twin=>plasticState(phase)%state(startIndex:endIndex,:)
|
||||
state0(instance)%threshold_stress_twin=>plasticState(phase)%state0(startIndex:endIndex,:)
|
||||
|
||||
startIndex=endIndex+1
|
||||
endIndex=endIndex+nt
|
||||
state(instance)%twinVolume=>plasticState(phase)%state(startIndex:endIndex,:)
|
||||
state0(instance)%twinVolume=>plasticState(phase)%state0(startIndex:endIndex,:)
|
||||
|
||||
startIndex=endIndex+1
|
||||
endIndex=endIndex+nt
|
||||
state(instance)%threshold_stress_twin=>plasticState(phase)%state(startIndex:endIndex,:)
|
||||
state0(instance)%threshold_stress_twin=>plasticState(phase)%state0(startIndex:endIndex,:)
|
||||
|
||||
startIndex=endIndex+1
|
||||
endIndex=endIndex+nt
|
||||
state(instance)%twinVolume=>plasticState(phase)%state(startIndex:endIndex,:)
|
||||
state0(instance)%twinVolume=>plasticState(phase)%state0(startIndex:endIndex,:)
|
||||
|
||||
call plastic_disloUCLA_stateInit(phase,instance)
|
||||
call plastic_disloUCLA_aTolState(phase,instance)
|
||||
endif myPhase2
|
||||
|
|
Loading…
Reference in New Issue