Clarified that UKS is not implemented in Device for the 'NOT YET IMPL…

…EMENTED' statements
wavefunction91 · Aug 9, 2023 · afb24bb · afb24bb
1 parent 4417d9b
commit afb24bb
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Showing 3 changed files with 9 additions and 9 deletions.
diff --git a/src/xc_integrator/local_work_driver/device/scheme1_base.cxx b/src/xc_integrator/local_work_driver/device/scheme1_base.cxx
@@ -278,13 +278,13 @@ void AoSScheme1Base::eval_zmat_gga_vxc_rks( XCDeviceData* _data){
 
 void AoSScheme1Base::eval_zmat_lda_vxc_uks( XCDeviceData* _data){
 
-  GAUXC_GENERIC_EXCEPTION("NOT YET IMPLEMENTED");
+  GAUXC_GENERIC_EXCEPTION("UKS NOT YET IMPLEMENTED FOR DEVICE");
 
 }
 
 void AoSScheme1Base::eval_zmat_gga_vxc_uks( XCDeviceData* _data){
 
-  GAUXC_GENERIC_EXCEPTION("NOT YET IMPLEMENTED");
+  GAUXC_GENERIC_EXCEPTION("UKS NOT YET IMPLEMENTED FOR DEVICE");
 
 }
 
@@ -478,13 +478,13 @@ void AoSScheme1Base::eval_uvvar_gga_rks( XCDeviceData* _data ){
 
 void AoSScheme1Base::eval_uvvar_lda_uks( XCDeviceData* _data ){
 
-  GAUXC_GENERIC_EXCEPTION("NOT YET IMPLEMENTED"); 
+  GAUXC_GENERIC_EXCEPTION("UKS NOT YET IMPLEMENTED FOR DEVICE"); 
 
 }
 
 void AoSScheme1Base::eval_uvvar_gga_uks( XCDeviceData* _data ){
 
-  GAUXC_GENERIC_EXCEPTION("NOT YET IMPLEMENTED");
+  GAUXC_GENERIC_EXCEPTION("UKS NOT YET IMPLEMENTED FOR DEVICE");
 
 }
 

diff --git a/src/xc_integrator/replicated/device/incore_replicated_xc_device_integrator_exc_vxc.hpp b/src/xc_integrator/replicated/device/incore_replicated_xc_device_integrator_exc_vxc.hpp
@@ -116,7 +116,7 @@ void IncoreReplicatedXCDeviceIntegrator<ValueType>::
                       value_type* VXCz, int64_t ldvxcz,
                       value_type* EXC ) {
 
-  GAUXC_GENERIC_EXCEPTION("NOT YET IMPLEMENTED");
+  GAUXC_GENERIC_EXCEPTION("UKS NOT YET IMPLEMENTED FOR DEVICE");
 }
 
 template <typename ValueType>
@@ -267,7 +267,7 @@ void IncoreReplicatedXCDeviceIntegrator<ValueType>::
                             host_task_iterator task_begin, host_task_iterator task_end,
                             XCDeviceData& device_data ) {
 
-  GAUXC_GENERIC_EXCEPTION("NOT YET IMPLEMENTED");
+  GAUXC_GENERIC_EXCEPTION("UKS NOT YET IMPLEMENTED FOR DEVICE");
 }
 
 template <typename ValueType>
@@ -279,7 +279,7 @@ void IncoreReplicatedXCDeviceIntegrator<ValueType>::
                             host_task_iterator task_begin, host_task_iterator task_end,
                             XCDeviceData& device_data ) {
 
-  GAUXC_GENERIC_EXCEPTION("NOT YET IMPLEMENTED");
+  GAUXC_GENERIC_EXCEPTION("UKS NOT YET IMPLEMENTED FOR DEVICE");
 }
 
 }

diff --git a/src/xc_integrator/replicated/device/shellbatched_replicated_xc_device_integrator_exc_vxc.hpp b/src/xc_integrator/replicated/device/shellbatched_replicated_xc_device_integrator_exc_vxc.hpp
@@ -94,7 +94,7 @@ void ShellBatchedReplicatedXCDeviceIntegrator<ValueType>::
                       value_type* VXCz, int64_t ldvxcz,
                       value_type* EXC ) {
 
-  GAUXC_GENERIC_EXCEPTION("NOT YET IMPLEMENTED");
+  GAUXC_GENERIC_EXCEPTION("UKS NOT YET IMPLEMENTED FOR DEVICE");
 }
 
 template <typename ValueType>
@@ -200,7 +200,7 @@ void ShellBatchedReplicatedXCDeviceIntegrator<ValueType>::
                             host_task_iterator task_begin, host_task_iterator task_end,
                             XCDeviceData& device_data ) {
 
-  GAUXC_GENERIC_EXCEPTION("NOT YET IMPLEMENTED");
+  GAUXC_GENERIC_EXCEPTION("UKS NOT YET IMPLEMENTED FOR DEVICE");
 }
 
 template <typename ValueType>