GFORTRAN module version '10' created from ldaUpen.f90 MD5:dec03a201a62870786e026f893fae775 -- If you edit this, you'll get what you deserve. (() () () () () () () () () () () () () () () () () () () () () () () () () () ()) () () () () () (2 'deallocate_step_pen' 'step_penalty' '' 1 ((PROCEDURE UNKNOWN-INTENT MODULE-PROC DECL UNKNOWN 0 0 SUBROUTINE) (UNKNOWN 0 0 0 0 UNKNOWN ()) 0 0 () () 0 () () () 0 0) 3 'ldaupen_init' 'step_penalty' '' 1 ((PROCEDURE UNKNOWN-INTENT MODULE-PROC DECL UNKNOWN 0 0 SUBROUTINE) (UNKNOWN 0 0 0 0 UNKNOWN ()) 4 0 (5 6 7 8 9) () 0 () () () 0 0) 10 'penalty_e' 'step_penalty' '' 1 ((PROCEDURE UNKNOWN-INTENT MODULE-PROC DECL UNKNOWN 0 0 SUBROUTINE) (UNKNOWN 0 0 0 0 UNKNOWN ()) 11 0 (12 13 14 15 16) () 0 () () () 0 0) 17 'penalty_f' 'step_penalty' '' 1 ((PROCEDURE UNKNOWN-INTENT MODULE-PROC DECL UNKNOWN 0 0 SUBROUTINE) (UNKNOWN 0 0 0 0 UNKNOWN ()) 18 0 (19 20 21 22) () 0 () () () 0 0) 23 'write_pen' 'step_penalty' '' 1 ((PROCEDURE UNKNOWN-INTENT MODULE-PROC DECL UNKNOWN 0 0 SUBROUTINE) (UNKNOWN 0 0 0 0 UNKNOWN ()) 24 0 (25 26) () 0 () () () 0 0) 5 'natx_' '' '' 4 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DUMMY) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 6 'step_pen_' '' '' 4 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DUMMY) (LOGICAL 4 0 0 0 LOGICAL ()) 0 0 () () 0 () () () 0 0) 7 'sigma_pen_' '' '' 4 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION DUMMY) (REAL 8 0 0 0 REAL ()) 0 0 () (1 0 EXPLICIT (CONSTANT ( INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 5 ())) 0 () () () 0 0) 8 'alpha_pen_' '' '' 4 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION DUMMY) (REAL 8 0 0 0 REAL ()) 0 0 () (1 0 EXPLICIT (CONSTANT ( INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 5 ())) 0 () () () 0 0) 9 'a_pen_' '' '' 4 ((VARIABLE IN 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 5 ()) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (CONSTANT ( INTEGER 4 0 0 0 INTEGER ()) 0 '2')) 0 () () () 0 0) 12 'offset' '' '' 11 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION DUMMY) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () (2 0 EXPLICIT ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 27 ()) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') ( VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 28 ())) 0 () () () 0 0) 13 'swfc' '' '' 11 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION DUMMY) (COMPLEX 8 0 0 0 COMPLEX ()) 0 0 () (2 0 EXPLICIT ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 29 ()) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') ( VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 30 ())) 0 () () () 0 0) 14 'proj' '' '' 11 ((VARIABLE IN 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 30 ()) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE ( INTEGER 4 0 0 0 INTEGER ()) 0 31 ())) 0 () () () 0 0) 15 'e_hubbard' '' '' 11 ((VARIABLE INOUT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DUMMY) (REAL 8 0 0 0 REAL ()) 0 0 () () 0 () () () 0 0) 16 'hpsi' '' '' 11 ((VARIABLE INOUT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION DUMMY) (COMPLEX 8 0 0 0 COMPLEX ()) 0 0 () (2 0 EXPLICIT ( CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 29 ()) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') ( VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 32 ())) 0 () () () 0 0) 19 'is' '' '' 18 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DUMMY) ( INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 20 'iat' '' '' 18 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DUMMY) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 21 'dns' '' '' 18 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DIMENSION DUMMY) (REAL 8 0 0 0 REAL ()) 0 0 () (4 0 EXPLICIT (CONSTANT ( INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 33 ()) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE ( INTEGER 4 0 0 0 INTEGER ()) 0 33 ()) (CONSTANT (INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 34 ()) (CONSTANT ( INTEGER 4 0 0 0 INTEGER ()) 0 '1') (VARIABLE (INTEGER 4 0 0 0 INTEGER ()) 0 35 ())) 0 () () () 0 0) 22 'forceh' '' '' 18 ((VARIABLE INOUT UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DUMMY) (REAL 8 0 0 0 REAL ()) 0 0 () () 0 () () () 0 0) 25 'nsp' '' '' 24 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DUMMY) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 26 'nspin' '' '' 24 ((VARIABLE IN UNKNOWN-PROC UNKNOWN UNKNOWN 0 0 DUMMY) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 27 'nsp' 'ions_base' '' 11 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 28 'nat' 'ions_base' '' 11 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 29 'ngw' 'gvecw' '' 11 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 30 'nwfcu' 'ldau_cp' '' 11 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 31 'nbsp' 'electrons_base' '' 11 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 32 'nbspx' 'electrons_base' '' 11 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 33 'ldmx' 'ldau_cp' '' 18 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 34 'nat' 'ions_base' '' 18 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) 35 'nspin' 'electrons_base' '' 18 ((VARIABLE UNKNOWN-INTENT UNKNOWN-PROC UNKNOWN EXPLICIT-SAVE 0 0) (INTEGER 4 0 0 0 INTEGER ()) 0 0 () () 0 () () () 0 0) ) ('deallocate_step_pen' 0 2 'ldaupen_init' 0 3 'penalty_e' 0 10 'penalty_f' 0 17 'write_pen' 0 23)