GFORTRAN module version '10' created from paw_onecenter.f90 MD5:1074dcbf5d52fc0c1e5b71cee04eee48 -- If you edit this, you'll get what you deserve. (() () () () () () () () () () () () () () () () () () () () () () () () () () ()) () () (('mpi_fortran_argv_null' 2 0 0 '') ('mpi_fortran_errcodes_ignore' 3 0 0 '') ('mpi_fortran_in_place' 4 0 0 '') ('mpi_fortran_status_ignore' 5 0 0 '') ('mpi_fortran_statuses_ignore' 6 0 0 '') ('mpi_fortran_argvs_null' 7 0 0 '') ('mpi_fortran_bottom' 8 0 0 '')) () () (9 'paw_ddot' 'paw_onecenter' '' 1 ((PROCEDURE UNKNOWN-INTENT MODULE-PROC DECL UNKNOWN 0 0 FUNCTION) (REAL 8 0 0 0 REAL ()) 10 0 (11 12) () 9 () () () 0 0) 13 'paw_dpotential' 'paw_onecenter' '' 1 ((PROCEDURE UNKNOWN-INTENT MODULE-PROC DECL UNKNOWN 0 0 SUBROUTINE) (UNKNOWN 0 0 0 0 UNKNOWN ()) 14 0 (15 16 17 18) () 0 () () () 0 0) 19 'paw_h_potential' 'paw_onecenter' '' 1 ((PROCEDURE UNKNOWN-INTENT MODULE-PROC DECL UNKNOWN 0 0 SUBROUTINE ALWAYS_EXPLICIT) (UNKNOWN 0 0 0 0 UNKNOWN ()) 20 0 (21 22 23 24) () 0 () () () 0 0) 25 'paw_potential' 'paw_onecenter' '' 1 ((PROCEDURE UNKNOWN-INTENT MODULE-PROC DECL UNKNOWN 0 0 SUBROUTINE ALWAYS_EXPLICIT) (UNKNOWN 0 0 0 0 UNKNOWN ()) 26 0 (27 28 29 30) () 0 () () () 0 0) 31 'paw_rho_lm' 'paw_onecenter' '' 1 ((PROCEDURE UNKNOWN-INTENT MODULE-PROC DECL UNKNOWN 0 0 SUBROUTINE ALWAYS_EXPLICIT) (UNKNOWN 0 0 0 0 UNKNOWN ()) 32 0 (33 34 35 36 37) () 0 () () () 0 0) 2 'mpi_argv_null' 'parallel_include' '' 1 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION IN_COMMON) (CHARACTER 1 0 0 0 CHARACTER ((CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1'))) 0 0 () (1 0 EXPLICIT (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (CONSTANT ( INTEGER 4 0 0 0 INTEGER ()) 0 '1')) 0 () () () 0 0) 3 'mpi_errcodes_ignore' 'parallel_include' '' 1 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION IN_COMMON) ( INTEGER 4 0 0 0 INTEGER ()) 0 0 () (1 0 EXPLICIT (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1')) 0 () () () 0 0) 4 'mpi_in_place' 'parallel_include' '' 1 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 IN_COMMON) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 5 'mpi_status_ignore' 'parallel_include' '' 1 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION IN_COMMON) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () (1 0 EXPLICIT (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '5')) 0 () () () 0 0) 6 'mpi_statuses_ignore' 'parallel_include' '' 1 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 IN_COMMON) (REAL 8 0 0 0 REAL ()) 0 0 () () 0 () () () 0 0) 7 'mpi_argvs_null' 'parallel_include' '' 1 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 IN_COMMON) (REAL 8 0 0 0 REAL ()) 0 0 () () 0 () () () 0 0) 8 'mpi_bottom' 'parallel_include' '' 1 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 IN_COMMON) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 11 'bec1' '' '' 10 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION DUMMY) (REAL 8 0 0 0 REAL ()) 0 0 () (3 0 EXPLICIT (CONSTANT ( INTEGER 4 0 0 0 INTEGER ()) 0 '1') (OP (INTEGER 4 0 0 0 INTEGER ()) 0 DIVIDE (OP (INTEGER 4 0 0 0 INTEGER ()) 0 TIMES (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 38 ()) (OP (INTEGER 4 0 0 0 INTEGER ()) 0 PARENTHESES ( OP (INTEGER 4 0 0 0 INTEGER ()) 0 PLUS (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 38 ()) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1')))) ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '2')) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 39 ()) ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 40 ())) 0 () () () 0 0) 12 'bec2' '' '' 10 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION DUMMY) (REAL 8 0 0 0 REAL ()) 0 0 () (3 0 EXPLICIT (CONSTANT ( INTEGER 4 0 0 0 INTEGER ()) 0 '1') (OP (INTEGER 4 0 0 0 INTEGER ()) 0 DIVIDE (OP (INTEGER 4 0 0 0 INTEGER ()) 0 TIMES (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 38 ()) (OP (INTEGER 4 0 0 0 INTEGER ()) 0 PARENTHESES ( OP (INTEGER 4 0 0 0 INTEGER ()) 0 PLUS (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 38 ()) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1')))) ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '2')) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 39 ()) ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 40 ())) 0 () () () 0 0) 15 'dbecsum' '' '' 14 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION DUMMY) (COMPLEX 8 0 0 0 COMPLEX ()) 0 0 () (4 0 EXPLICIT ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (OP (INTEGER 4 0 0 0 INTEGER ()) 0 DIVIDE (OP (INTEGER 4 0 0 0 INTEGER ()) 0 TIMES (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 41 ()) (OP (INTEGER 4 0 0 0 INTEGER ()) 0 PARENTHESES (OP (INTEGER 4 0 0 0 INTEGER ()) 0 PLUS (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 41 ()) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1')))) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '2')) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 42 ()) ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 43 ()) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') ( VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 18 ())) 0 () () () 0 0) 16 'becsum' '' '' 14 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION DUMMY) (REAL 8 0 0 0 REAL ()) 0 0 () (3 0 EXPLICIT (CONSTANT ( INTEGER 4 0 0 0 INTEGER ()) 0 '1') (OP (INTEGER 4 0 0 0 INTEGER ()) 0 DIVIDE (OP (INTEGER 4 0 0 0 INTEGER ()) 0 TIMES (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 41 ()) (OP (INTEGER 4 0 0 0 INTEGER ()) 0 PARENTHESES ( OP (INTEGER 4 0 0 0 INTEGER ()) 0 PLUS (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 41 ()) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1')))) ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '2')) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 42 ()) ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 43 ())) 0 () () () 0 0) 17 'int3' '' '' 14 ((VARIABLE OUT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION DUMMY) (COMPLEX 8 0 0 0 COMPLEX ()) 0 0 () (5 0 EXPLICIT ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 41 ()) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') ( VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 41 ()) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 42 ()) ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 43 ()) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') ( VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 18 ())) 0 () () () 0 0) 18 'npe' '' '' 14 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DUMMY) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 21 'i' '' '' 20 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DUMMY) ( DERIVED 44 0 0 0 DERIVED ()) 0 0 () () 0 () () () 0 0) 22 'rho_lm' '' '' 20 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION DUMMY) (REAL 8 0 0 0 REAL ()) 0 0 () (3 0 EXPLICIT (CONSTANT ( INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 21 ((COMPONENT 44 45))) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (OP (INTEGER 4 0 0 0 INTEGER ()) 0 POWER (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 21 ((COMPONENT 44 46))) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '2')) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE ( INTEGER 4 0 0 0 INTEGER ()) 0 47 ())) 0 () () () 0 0) 23 'v_lm' '' '' 20 ((VARIABLE OUT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION DUMMY) (REAL 8 0 0 0 REAL ()) 0 0 () (2 0 EXPLICIT (CONSTANT ( INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 21 ((COMPONENT 44 45))) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (OP (INTEGER 4 0 0 0 INTEGER ()) 0 POWER (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 21 ((COMPONENT 44 46))) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '2'))) 0 () () () 0 0) 24 'energy' '' '' 20 ((VARIABLE OUT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 OPTIONAL DUMMY) (REAL 8 0 0 0 REAL ()) 0 0 () () 0 () () () 0 0) 27 'becsum' '' '' 26 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION DUMMY) (REAL 8 0 0 0 REAL ()) 0 0 () (3 0 EXPLICIT (CONSTANT ( INTEGER 4 0 0 0 INTEGER ()) 0 '1') (OP (INTEGER 4 0 0 0 INTEGER ()) 0 DIVIDE (OP (INTEGER 4 0 0 0 INTEGER ()) 0 TIMES (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 48 ()) (OP (INTEGER 4 0 0 0 INTEGER ()) 0 PARENTHESES ( OP (INTEGER 4 0 0 0 INTEGER ()) 0 PLUS (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 48 ()) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1')))) ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '2')) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 49 ()) ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 50 ())) 0 () () () 0 0) 28 'd' '' '' 26 ((VARIABLE OUT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION DUMMY) (REAL 8 0 0 0 REAL ()) 0 0 () (3 0 EXPLICIT (CONSTANT ( INTEGER 4 0 0 0 INTEGER ()) 0 '1') (OP (INTEGER 4 0 0 0 INTEGER ()) 0 DIVIDE (OP (INTEGER 4 0 0 0 INTEGER ()) 0 TIMES (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 48 ()) (OP (INTEGER 4 0 0 0 INTEGER ()) 0 PARENTHESES ( OP (INTEGER 4 0 0 0 INTEGER ()) 0 PLUS (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 48 ()) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1')))) ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '2')) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 49 ()) ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 50 ())) 0 () () () 0 0) 29 'energy' '' '' 26 ((VARIABLE OUT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 OPTIONAL DUMMY) (REAL 8 0 0 0 REAL ()) 0 0 () () 0 () () () 0 0) 30 'e_cmp' '' '' 26 ((VARIABLE OUT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION OPTIONAL DUMMY) (REAL 8 0 0 0 REAL ()) 0 0 () (3 0 EXPLICIT ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 49 ()) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '2') (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '2')) 0 () () () 0 0) 33 'i' '' '' 32 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DUMMY) ( DERIVED 44 0 0 0 DERIVED ()) 0 0 () () 0 () () () 0 0) 34 'becsum' '' '' 32 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION DUMMY) (REAL 8 0 0 0 REAL ()) 0 0 () (3 0 EXPLICIT (CONSTANT ( INTEGER 4 0 0 0 INTEGER ()) 0 '1') (OP (INTEGER 4 0 0 0 INTEGER ()) 0 DIVIDE (OP (INTEGER 4 0 0 0 INTEGER ()) 0 TIMES (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 51 ()) (OP (INTEGER 4 0 0 0 INTEGER ()) 0 PARENTHESES ( OP (INTEGER 4 0 0 0 INTEGER ()) 0 PLUS (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 51 ()) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1')))) ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '2')) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 52 ()) ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 53 ())) 0 () () () 0 0) 35 'pfunc' '' '' 32 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION DUMMY) (REAL 8 0 0 0 REAL ()) 0 0 () (3 0 EXPLICIT (CONSTANT ( INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 33 ((COMPONENT 44 45))) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 33 ((COMPONENT 44 54))) ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 33 ((COMPONENT 44 54)))) 0 () () () 0 0) 36 'rho_lm' '' '' 32 ((VARIABLE OUT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION DUMMY) (REAL 8 0 0 0 REAL ()) 0 0 () (3 0 EXPLICIT (CONSTANT ( INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 33 ((COMPONENT 44 45))) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (OP (INTEGER 4 0 0 0 INTEGER ()) 0 POWER (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 33 ((COMPONENT 44 46))) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '2')) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE ( INTEGER 4 0 0 0 INTEGER ()) 0 53 ())) 0 () () () 0 0) 37 'aug' '' '' 32 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION OPTIONAL DUMMY) (REAL 8 0 0 0 REAL ()) 0 0 () (3 0 EXPLICIT ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 33 ((COMPONENT 44 45))) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (OP (INTEGER 4 0 0 0 INTEGER ()) 0 DIVIDE (OP (INTEGER 4 0 0 0 INTEGER ()) 0 PARENTHESES (OP (INTEGER 4 0 0 0 INTEGER ()) 0 TIMES ( VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 33 ((COMPONENT 44 54))) (OP ( INTEGER 4 0 0 0 INTEGER ()) 0 PARENTHESES (OP (INTEGER 4 0 0 0 INTEGER ()) 0 PLUS (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 33 ((COMPONENT 44 54))) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1'))))) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '2')) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '0') ( OP (INTEGER 4 0 0 0 INTEGER ()) 0 TIMES (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '2') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 55 ((ARRAY ( ELEMENT 1 (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 33 ((COMPONENT 44 56))) 1)) (COMPONENT 57 58))))) 0 () () () 0 0) 38 'nhm' 'uspp_param' '' 10 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 39 'nat' 'ions_base' '' 10 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 40 'nspin' 'lsda_mod' '' 10 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 41 'nhm' 'uspp_param' '' 14 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 42 'nat' 'ions_base' '' 14 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 43 'nspin_mag' 'noncollin_module' '' 14 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 44 'Paw_info' 'paw_variables' '' 1 ((DERIVED UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) (UNKNOWN 0 0 0 0 UNKNOWN ()) 0 0 () () 0 ((59 'a' ( INTEGER 4 0 0 0 INTEGER ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (56 't' (INTEGER 4 0 0 0 INTEGER ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (45 'm' (INTEGER 4 0 0 0 INTEGER ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (54 'b' (INTEGER 4 0 0 0 INTEGER ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (46 'l' (INTEGER 4 0 0 0 INTEGER ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (60 'ae' (INTEGER 4 0 0 0 INTEGER ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ())) PUBLIC (() () () ()) () 0 0 47488232) 47 'nspin' 'lsda_mod' '' 20 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 48 'nhm' 'uspp_param' '' 26 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 49 'nat' 'ions_base' '' 26 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 50 'nspin' 'lsda_mod' '' 26 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 51 'nhm' 'uspp_param' '' 32 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 52 'nat' 'ions_base' '' 32 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 53 'nspin_mag' 'noncollin_module' '' 32 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 55 'upf' 'uspp_param' '' 32 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0 ALLOCATABLE DIMENSION TARGET) (DERIVED 57 0 0 0 DERIVED ()) 0 0 () (1 0 DEFERRED () ()) 0 () () () 0 0) 57 'Pseudo_upf' 'pseudo_types' '' 32 ((DERIVED UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 POINTER_COMP) (UNKNOWN 0 0 0 0 UNKNOWN ()) 0 0 () () 0 ((61 'generated' (CHARACTER 1 0 0 0 CHARACTER (( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '80'))) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ( CONSTANT (CHARACTER 1 0 0 0 CHARACTER (())) 0 80 ' ')) (62 'author' (CHARACTER 1 0 0 0 CHARACTER ((CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '80'))) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS (CONSTANT (CHARACTER 1 0 0 0 CHARACTER (())) 0 80 ' ')) (63 'date' (CHARACTER 1 0 0 0 CHARACTER ((CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '80'))) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS (CONSTANT (CHARACTER 1 0 0 0 CHARACTER (())) 0 80 ' ')) (64 'comment' (CHARACTER 1 0 0 0 CHARACTER ((CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '80'))) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS (CONSTANT (CHARACTER 1 0 0 0 CHARACTER (())) 0 80 ' ')) (65 'psd' (CHARACTER 1 0 0 0 CHARACTER ((CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '2'))) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS (CONSTANT (CHARACTER 1 0 0 0 CHARACTER (())) 0 2 ' ')) (66 'typ' (CHARACTER 1 0 0 0 CHARACTER ((CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '20'))) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS (CONSTANT (CHARACTER 1 0 0 0 CHARACTER (())) 0 20 ' ')) (67 'rel' (CHARACTER 1 0 0 0 CHARACTER ((CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '6'))) () ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS (CONSTANT (CHARACTER 1 0 0 0 CHARACTER (())) 0 6 ' ')) (68 'tvanp' (LOGICAL 4 0 0 0 LOGICAL ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (69 'tcoulombp' ( LOGICAL 4 0 0 0 LOGICAL ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (70 'nlcc' (LOGICAL 4 0 0 0 LOGICAL ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (71 'is_gth' (LOGICAL 4 0 0 0 LOGICAL ()) () ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (72 'dft' (CHARACTER 1 0 0 0 CHARACTER ((CONSTANT ( INTEGER 4 0 0 0 INTEGER ()) 0 '25'))) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (73 'zp' (REAL 8 0 0 0 REAL ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (74 'etotps' (REAL 8 0 0 0 REAL ()) () ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (75 'ecutwfc' (REAL 8 0 0 0 REAL ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (76 'ecutrho' (REAL 8 0 0 0 REAL ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (77 'nv' ( CHARACTER 1 0 0 0 CHARACTER ((CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '11'))) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (58 'lmax' (INTEGER 4 0 0 0 INTEGER ()) () ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (78 'lmax_rho' (INTEGER 4 0 0 0 INTEGER ()) () ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (79 'vnl' (REAL 8 0 0 0 REAL ()) (3 0 DEFERRED () () () () () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (80 'nwfc' (INTEGER 4 0 0 0 INTEGER ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (81 'nbeta' (INTEGER 4 0 0 0 INTEGER ()) () ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (82 'kbeta' (INTEGER 4 0 0 0 INTEGER ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (83 'kkbeta' (INTEGER 4 0 0 0 INTEGER ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (84 'lll' (INTEGER 4 0 0 0 INTEGER ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (85 'beta' (REAL 8 0 0 0 REAL ()) (2 0 DEFERRED () () () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (86 'els' ( CHARACTER 1 0 0 0 CHARACTER ((CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '2'))) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (87 'els_beta' ( CHARACTER 1 0 0 0 CHARACTER ((CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '2'))) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (88 'nchi' (INTEGER 4 0 0 0 INTEGER ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) ( 89 'lchi' (INTEGER 4 0 0 0 INTEGER ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (90 'oc' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (91 'epseu' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (92 'rcut_chi' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (93 'rcutus_chi' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) ( 94 'chi' (REAL 8 0 0 0 REAL ()) (2 0 DEFERRED () () () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (95 'rho_at' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (96 'mesh' (INTEGER 4 0 0 0 INTEGER ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (97 'xmin' (REAL 8 0 0 0 REAL ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (98 'rmax' (REAL 8 0 0 0 REAL ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (99 'zmesh' (REAL 8 0 0 0 REAL ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (100 'dx' (REAL 8 0 0 0 REAL ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) ( 101 'r' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (102 'rab' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (103 'rho_atc' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (104 'lloc' (INTEGER 4 0 0 0 INTEGER ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (105 'rcloc' (REAL 8 0 0 0 REAL ()) () ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (106 'vloc' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (107 'dion' (REAL 8 0 0 0 REAL ()) (2 0 DEFERRED () () () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (108 'q_with_l' ( LOGICAL 4 0 0 0 LOGICAL ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (109 'nqf' (INTEGER 4 0 0 0 INTEGER ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (110 'nqlc' (INTEGER 4 0 0 0 INTEGER ()) () ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (111 'qqq_eps' (REAL 8 0 0 0 REAL ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) ( 112 'rinner' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (113 'qqq' (REAL 8 0 0 0 REAL ()) (2 0 DEFERRED () () () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (114 'qfunc' (REAL 8 0 0 0 REAL ()) (2 0 DEFERRED () () () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (115 'qfuncl' (REAL 8 0 0 0 REAL ()) (3 0 DEFERRED () () () () () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (116 'qfcoef' (REAL 8 0 0 0 REAL ()) (4 0 DEFERRED () () () () () () () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (117 'has_wfc' ( LOGICAL 4 0 0 0 LOGICAL ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (118 'aewfc' (REAL 8 0 0 0 REAL ()) (2 0 DEFERRED () () () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (119 'pswfc' ( REAL 8 0 0 0 REAL ()) (2 0 DEFERRED () () () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (120 'has_so' (LOGICAL 4 0 0 0 LOGICAL ()) () ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (121 'nn' (INTEGER 4 0 0 0 INTEGER ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (122 'rcut' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (123 'rcutus' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) ( 124 'jchi' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (125 'jjj' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (126 'paw_data_format' (INTEGER 4 0 0 0 INTEGER ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (127 'tpawp' (LOGICAL 4 0 0 0 LOGICAL ()) () ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (128 'paw' (DERIVED 129 0 0 0 DERIVED ()) () ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (130 'grid' (DERIVED 131 0 0 0 DERIVED ()) () ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 POINTER) UNKNOWN-ACCESS ()) (132 'has_gipaw' (LOGICAL 4 0 0 0 LOGICAL ()) () ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (133 'paw_as_gipaw' (LOGICAL 4 0 0 0 LOGICAL ()) () ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (134 'gipaw_data_format' (INTEGER 4 0 0 0 INTEGER ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (135 'gipaw_ncore_orbitals' (INTEGER 4 0 0 0 INTEGER ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (136 'gipaw_core_orbital_n' (REAL 8 0 0 0 REAL ()) ( 1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (137 'gipaw_core_orbital_l' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (138 'gipaw_core_orbital_el' (CHARACTER 1 0 0 0 CHARACTER ((CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '2'))) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (139 'gipaw_core_orbital' ( REAL 8 0 0 0 REAL ()) (2 0 DEFERRED () () () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (140 'gipaw_vlocal_ae' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (141 'gipaw_vlocal_ps' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) ( 142 'gipaw_wfs_nchannels' (INTEGER 4 0 0 0 INTEGER ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) ( 143 'gipaw_wfs_el' (CHARACTER 1 0 0 0 CHARACTER ((CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '2'))) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) ( 144 'gipaw_wfs_ll' (INTEGER 4 0 0 0 INTEGER ()) (1 0 DEFERRED () ()) ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (145 'gipaw_wfs_ae' (REAL 8 0 0 0 REAL ()) ( 2 0 DEFERRED () () () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (146 'gipaw_wfs_rcut' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (147 'gipaw_wfs_rcutus' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (148 'gipaw_wfs_ps' ( REAL 8 0 0 0 REAL ()) (2 0 DEFERRED () () () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (149 'md5_cksum' (CHARACTER 1 0 0 0 CHARACTER (( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '32'))) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ( CONSTANT (CHARACTER 1 0 0 0 CHARACTER (())) 0 32 'NOT SET '))) PUBLIC (() () () ()) () 0 0 38867441) 129 'Paw_in_upf' 'pseudo_types' '' 32 ((DERIVED UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 POINTER_COMP) (UNKNOWN 0 0 0 0 UNKNOWN ()) 0 0 () () 0 ((150 'ae_rho_atc' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (151 'pfunc' (REAL 8 0 0 0 REAL ()) (3 0 DEFERRED () () () () () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (152 'pfunc_rel' (REAL 8 0 0 0 REAL ()) (3 0 DEFERRED () () () () () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (153 'ptfunc' (REAL 8 0 0 0 REAL ()) (3 0 DEFERRED () () () () () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (154 'aewfc_rel' (REAL 8 0 0 0 REAL ()) (2 0 DEFERRED () () () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) ( 155 'ae_vloc' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (156 'oc' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (157 'augmom' (REAL 8 0 0 0 REAL ()) (3 0 DEFERRED () () () () () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (158 'raug' ( REAL 8 0 0 0 REAL ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (159 'iraug' (INTEGER 4 0 0 0 INTEGER ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (160 'lmax_aug' (INTEGER 4 0 0 0 INTEGER ()) () ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (161 'core_energy' (REAL 8 0 0 0 REAL ()) () ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (162 'augshape' (CHARACTER 1 0 0 0 CHARACTER (( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '12'))) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ())) PUBLIC (() () () ()) () 0 0 94580081) 131 'Radial_grid_type' 'radial_grids' '' 32 ((DERIVED UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 POINTER_COMP) (UNKNOWN 0 0 0 0 UNKNOWN ()) 0 0 () () 0 ((163 'mesh' (INTEGER 4 0 0 0 INTEGER ()) () ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (164 'r' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (165 'r2' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (166 'rab' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (167 'sqr' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (168 'rm1' ( REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) ( 169 'rm2' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (170 'rm3' (REAL 8 0 0 0 REAL ()) (1 0 DEFERRED () ()) (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION POINTER) UNKNOWN-ACCESS ()) (171 'xmin' (REAL 8 0 0 0 REAL ()) () ( UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (172 'rmax' (REAL 8 0 0 0 REAL ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) ( 173 'zmesh' (REAL 8 0 0 0 REAL ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ()) (174 'dx' (REAL 8 0 0 0 REAL ()) () (UNKNOWN-FL UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0) UNKNOWN-ACCESS ())) PUBLIC (() () () ()) () 0 0 1308965) ) ('paw_ddot' 0 9 'paw_dpotential' 0 13 'paw_h_potential' 0 19 'paw_potential' 0 25 'paw_rho_lm' 0 31)