DENSITY AT NUCLEUS
        JATOM    VALENCE       SEMI-CORE            CORE           TOTAL

:RTO001:   1      573.404878        0.000000   595355.649360   595929.054238
     
       CHARGES OF NEW CHARGE DENSITY
:NTO  : TOTAL   INTERSTITIAL CHARGE=    2.8744634
:NTO001: TOTAL   CHARGE IN SPHERE  1 =       55.1248057

:NEC01: NUCLEAR AND ELECTRONIC CHARGE     58.00000    57.99927     1.00001
     
       CHARGES OF OLD CHARGE DENSITY
:OTO  : TOTAL   INTERSTITIAL CHARGE=    2.8751705
:OTO001: TOTAL   CHARGE IN SPHERE  1 =       55.1248295

:NEC02: NUCLEAR AND ELECTRONIC CHARGE     58.00000    58.00000     1.00000
     
       CONVERGENCE TEST
:DTO001: TOTAL   DIFFERENCE CHARGE**2 IN SPHERE  1 =  0.0000218

:DIS  :  CHARGE DISTANCE       ( 0.0000218 for atom    1 spin 1)      0.0000218
:BIG check (qbig,qrms,qtot)    0.727D-05   0.154D-04   0.218D-04
 
******************************************************
* MULTISECANT MIXING OPTIONS                         *
* NFL Limit   0.100000                               *
* Diag Parm   0.000500                               *
* Standard Increase/Decrease Bounds                  *
* Plane Wave SQRT Dynamic Rescaling                  *
* Max Number of Memory Steps    8                    *
******************************************************
 
:PLANE:  INTERSTITIAL TOTAL      4.16754 DISTAN   0.0000009
:CHARG:  CLM CHARGE   TOTAL      5.97250 DISTAN   0.0000035
:REDuction and DMIX in Broyd:    1.1000    0.2000
:INFO :  Dynamic rescale   0.268D+01
:INFO :  Number of Memory Steps    8 Skipping   21
:INFO :  Reduction   0.2944 Expected   0.2361 Next   0.3561 All   0.3614
:INFO :  Bounds         0.400D+00  0.200D+00  0.281D+00  0.200D+00
:DIRM :  MEMORY 8/8 RESCALE  2.678 RED    0.294 PRED  0.236 NEXT  0.356
:INFO :  DMIXM and Projections     0.200D+00  0.356D+00
:DIRP :  |BROYD|= 0.261D-04 |PRATT|= 0.672D-05 ANGLE=  31.4 DEGREES
:DIRB :  |BROYD|= 0.116D-03 |PRATT|= 0.445D-04 ANGLE=  31.8 DEGREES
       MSEC1 MIXING SCHEME WITH 0.200
     
       CHARGES OF MIXED CHARGE DENSITY
:CTO  : TOTAL   INTERSTITIAL CHARGE=    2.8751831
:CTO001: TOTAL   CHARGE IN SPHERE  1 =       55.1248169

:NEC03: NUCLEAR AND ELECTRONIC CHARGE     58.00000    58.00000     1.00000


:ENE  : ********** TOTAL ENERGY IN Ry =       -17733.812370