| 9 |
|
private |
| 10 |
|
|
| 11 |
|
type (Vector), pointer, public :: atypes => null() |
| 12 |
– |
logical :: atype_vector_initialized = .false. |
| 12 |
|
|
| 13 |
+ |
|
| 14 |
|
public :: new_atype |
| 15 |
|
|
| 16 |
|
contains |
| 41 |
|
|
| 42 |
|
status = 0 |
| 43 |
|
|
| 44 |
< |
if (.not.atype_vector_initialized) then |
| 44 |
> |
if (.not. associated(atypes)) then |
| 45 |
|
!! There are 16 properties to worry about for now. |
| 46 |
|
!! Fix this if needed for more atomic properties |
| 47 |
< |
atypes = initialize(16) |
| 47 |
> |
write(*,*) "Initializing atypes directly" |
| 48 |
> |
atypes => initialize(16) |
| 49 |
|
if (.not.associated(atypes)) then |
| 50 |
|
status = -1 |
| 51 |
|
return |
| 53 |
|
endif |
| 54 |
|
|
| 55 |
|
me = addElement(atypes) |
| 55 |
– |
|
| 56 |
|
call setElementProperty(atypes, me, "c_ident", c_ident) |
| 57 |
|
|
| 58 |
|
l_is_LJ = (is_LJ .ne. 0) |
