Merge branch 'dev-stable'

plugins/local/tc_int/uninstall

@@ -9,5 +9,5 @@ then
 fi
 
 rm -rf ${PWD}/CuTC
-rm ${QP_ROOT}/lib/libcutcint.so
+rm -f ${QP_ROOT}/lib/libcutcint.so
 

scripts/qp_import_trexio.py

@@ -261,13 +261,10 @@ def write_ezfio(trexio_filename, filename):
     except:
         cartesian = True
 
-    if not cartesian:
-        raise TypeError('Only cartesian TREXIO files can be converted')
-
     ao_num = trexio.read_ao_num(trexio_file)
     ezfio.set_ao_basis_ao_num(ao_num)
 
-    if shell_num > 0:
+    if cartesian and shell_num > 0:
         ao_shell    = trexio.read_ao_shell(trexio_file)
         at = [ nucl_index[i]+1 for i in ao_shell ]
         ezfio.set_ao_basis_ao_nucl(at)
@@ -330,7 +327,7 @@ def write_ezfio(trexio_filename, filename):
         print("OK")
 
     else:
-        print("None")
+        print("None: integrals should be also imported using qp run import_trexio_integrals")
 
 
     #                _

src/gpu/gpu_module.F90

@@ -143,7 +143,7 @@ module gpu
       b, ldb, c, ldc) bind(C, name='gpu_dgeam')
       import
       type(c_ptr), value, intent(in)        :: handle
-      character(c_char), intent(in), value  :: transa, transb
+      character(c_char), intent(in)         :: transa, transb
       integer(c_int64_t), intent(in), value :: m, n, lda, ldb, ldc
       real(c_double), intent(in)            :: alpha, beta
       type(c_ptr), value :: a, b, c
@@ -153,7 +153,7 @@ module gpu
       b, ldb, c, ldc) bind(C, name='gpu_sgeam')
       import
       type(c_ptr), value, intent(in)        :: handle
-      character(c_char), intent(in), value  :: transa, transb
+      character(c_char), intent(in)         :: transa, transb
       integer(c_int64_t), intent(in), value :: m, n, lda, ldb, ldc
       real(c_float), intent(in)             :: alpha, beta
       real(c_float) :: a, b, c
@@ -194,7 +194,7 @@ module gpu
       b, ldb, beta, c, ldc) bind(C, name='gpu_sgemm')
       import
       type(c_ptr), value, intent(in)        :: handle
-      character(c_char), intent(in), value  :: transa, transb
+      character(c_char), intent(in)         :: transa, transb
       integer(c_int64_t), intent(in), value :: m, n, k, lda, ldb, ldc
       real(c_float), intent(in)             :: alpha, beta
       real(c_float) :: a, b, c