
  ___ ___ ___ _ _ _  
 |   |   |_  | | | | 
 | | | | | . | | | | 
 |__ |  _|___|_____|  23.9.2b1
 |___|_|             

User:   aes38@compute-7
Date:   Thu Oct  5 14:10:07 2023
Arch:   x86_64
Pid:    27418
CWD:    /users/home/aes38/Rydberg/new/ammonia/reallcao/5gmf
Python: 3.9.6
gpaw:   /users/home/aes38/new-gmf-gpaw/gpaw (f5d5d6d24c)
_gpaw:  /users/home/aes38/new-gmf-gpaw/build/lib.linux-x86_64-3.9/
        _gpaw.cpython-39-x86_64-linux-gnu.so (7a0e975e9f)
ase:    /hpcapps/source/ase_dev/ase (version 3.23.0b1-d4c62f2276)
numpy:  /users/home/eojons/easybuild/software/Python/3.9.6-GCCcore-11.2.0/lib/python3.9/site-packages/numpy (version 1.22.3)
scipy:  /users/home/eojons/easybuild/software/Python/3.9.6-GCCcore-11.2.0/lib/python3.9/site-packages/scipy (version 1.8.0)
libxc:  5.1.6
units:  Angstrom and eV
cores: 48
OpenMP: False
OMP_NUM_THREADS: 1

|-------------------------------------------------------|
|             Davidson partial diagonalizer             |
|-------------------------------------------------------|

Davidson will target the 5 lowest eigenpairs as recovered from previous calculation.
Dimensionality of Krylov space: 5

Eigenvalues:

         1          2          3          4          5 
 -0.908202   2.873579   2.888645   3.064489   3.169118 

Residual maximum components:

         1          2          3          4          5 
  0.153791   0.321823   0.365283   0.646797    0.38488 
Dimensionality of Krylov space: 10

Eigenvalues:

         1          2          3          4          5 
 -0.957068   1.415977   1.478097   1.569051   1.793527 

Residual maximum components:

         1          2          3          4          5 
  0.089293   0.285591   0.298594   0.320407   0.465153 
Dimensionality of Krylov space: 15

Eigenvalues:

         1          2          3          4          5 
 -0.966505   0.592258   0.751971   0.936274   1.167633 

Residual maximum components:

         1          2          3          4          5 
  0.038883   0.314902   0.291598   0.374054   0.390354 
Dimensionality of Krylov space: 20

Eigenvalues:

         1          2          3          4          5 
 -0.968790   0.202250   0.391332   0.574479   0.656988 

Residual maximum components:

         1          2          3          4          5 
  0.019027   0.186333   0.275356   0.358479   0.201838 
Dimensionality of Krylov space: 25

Eigenvalues:

         1          2          3          4          5 
 -0.969331   0.024889   0.202192   0.283004   0.603552 

Residual maximum components:

         1          2          3          4          5 
 0.008933c   0.191726   0.150977   0.220454   0.112777 
Dimensionality of Krylov space: 30

Eigenvalues:

         1          2          3          4          5 
 -0.969488  -0.068351  -0.018758   0.174418   0.365011 

Residual maximum components:

         1          2          3          4          5 
 0.003591c   0.141575   0.097427   0.107088   0.181986 
Dimensionality of Krylov space: 35

Eigenvalues:

         1          2          3          4          5 
 -0.969510  -0.144264  -0.077282  -0.034774   0.257168 

Residual maximum components:

         1          2          3          4          5 
 0.001882c   0.174214   0.071792    0.08365   0.070651 
Dimensionality of Krylov space: 40

Eigenvalues:

         1          2          3          4          5 
 -0.969517  -0.181404  -0.129554  -0.088216   0.106265 

Residual maximum components:

         1          2          3          4          5 
 0.000839c   0.043857   0.055291   0.083752   0.070864 
Dimensionality of Krylov space: 45

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.189848  -0.160523  -0.134347   0.055271 

Residual maximum components:

         1          2          3          4          5 
 0.000286c   0.033289   0.030038   0.050102   0.041079 
Dimensionality of Krylov space: 50

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.192493  -0.170299  -0.139442   0.041432 

Residual maximum components:

         1          2          3          4          5 
  0.00015c   0.032065   0.022235   0.020783   0.036141 
Dimensionality of Krylov space: 55

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193018  -0.174097  -0.140717   0.030234 

Residual maximum components:

         1          2          3          4          5 
 0.000111c   0.031601   0.016249   0.017749   0.035368 
Dimensionality of Krylov space: 60

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193234  -0.175636  -0.141212   0.020448 

Residual maximum components:

         1          2          3          4          5 
 0.000115c   0.031518   0.011631   0.017276   0.026288 
Dimensionality of Krylov space: 65

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193331  -0.176319  -0.141343   0.009300 

Residual maximum components:

         1          2          3          4          5 
 0.000117c   0.031589   0.013756   0.017175   0.027898 
Dimensionality of Krylov space: 70

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193413  -0.176669  -0.141434  -0.003703 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.031473   0.013653   0.016841   0.034386 
Dimensionality of Krylov space: 75

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193515  -0.176834  -0.141567  -0.011199 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.031591   0.014182   0.016372   0.031699 
Dimensionality of Krylov space: 80

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193572  -0.176908  -0.141732  -0.015149 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.031678    0.01474   0.015558   0.025191 
Dimensionality of Krylov space: 85

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193603  -0.176946  -0.141872  -0.017285 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.031751   0.015047   0.015686   0.021613 
Dimensionality of Krylov space: 90

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193617  -0.176971  -0.141940  -0.018724 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.031769   0.015273   0.016109   0.021474 
Dimensionality of Krylov space: 95

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193634  -0.176984  -0.142019  -0.019462 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.031797   0.015429   0.016681   0.022037 
Dimensionality of Krylov space: 100

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193658  -0.176990  -0.142154  -0.019788 

Residual maximum components:

         1          2          3          4          5 
 0.000119c    0.03183   0.015556   0.017613   0.022582 
Dimensionality of Krylov space: 105

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193672  -0.176994  -0.142314  -0.020175 

Residual maximum components:

         1          2          3          4          5 
 0.000119c    0.03183   0.015661   0.018662   0.023445 
Dimensionality of Krylov space: 110

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193677  -0.176997  -0.142383  -0.020508 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.031864   0.015729   0.019101    0.02413 
Dimensionality of Krylov space: 115

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193683  -0.177003  -0.142412  -0.020722 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.031958   0.015787   0.019232   0.024568 
Dimensionality of Krylov space: 120

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193688  -0.177006  -0.142422  -0.020815 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032029   0.015818   0.019257   0.024743 
Dimensionality of Krylov space: 125

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193693  -0.177009  -0.142427  -0.020906 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032096   0.015837   0.019256   0.024858 
Dimensionality of Krylov space: 130

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193697  -0.177010  -0.142429  -0.020995 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032115   0.015841   0.019271   0.024917 
Dimensionality of Krylov space: 135

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193699  -0.177011  -0.142432  -0.021089 

Residual maximum components:

         1          2          3          4          5 
 0.000119c    0.03212   0.015851   0.019323   0.024811 
Dimensionality of Krylov space: 140

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193701  -0.177011  -0.142436  -0.021832 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032125    0.01586   0.019364    0.05687 
Dimensionality of Krylov space: 145

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193702  -0.177012  -0.142439  -0.023909 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032126   0.015866    0.01938   0.062051 
Dimensionality of Krylov space: 150

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193703  -0.177012  -0.142440  -0.024356 

Residual maximum components:

         1          2          3          4          5 
 0.000119c    0.03213   0.015873   0.019384   0.061927 
Dimensionality of Krylov space: 155

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193704  -0.177013  -0.142442  -0.024496 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032142   0.015879   0.019388   0.061917 
Dimensionality of Krylov space: 160

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193705  -0.177014  -0.142443  -0.024566 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032159   0.015883   0.019394   0.061882 
Dimensionality of Krylov space: 165

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193707  -0.177014  -0.142444  -0.024604 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032174   0.015888   0.019405   0.061956 
Dimensionality of Krylov space: 170

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193710  -0.177015  -0.142445  -0.024628 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032191   0.015898   0.019412   0.061984 
Dimensionality of Krylov space: 175

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193711  -0.177016  -0.142446  -0.024642 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032203   0.015904   0.019414   0.062016 
Dimensionality of Krylov space: 180

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193712  -0.177017  -0.142446  -0.024733 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032215   0.015912   0.019419   0.061863 
Dimensionality of Krylov space: 185

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193715  -0.177018  -0.142447  -0.024806 

Residual maximum components:

         1          2          3          4          5 
 0.000119c    0.03224   0.015917   0.019421   0.061715 
Dimensionality of Krylov space: 190

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193717  -0.177018  -0.142448  -0.024841 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032259    0.01592   0.019422    0.06172 
Dimensionality of Krylov space: 195

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193719  -0.177018  -0.142449  -0.024859 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032271   0.015924   0.019426   0.061609 
Dimensionality of Krylov space: 200

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193721  -0.177019  -0.142450  -0.024871 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032287    0.01593   0.019436   0.061568 
Dimensionality of Krylov space: 205

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193722  -0.177020  -0.142451  -0.024888 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032303   0.015933   0.019438   0.061544 
Dimensionality of Krylov space: 210

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193723  -0.177020  -0.142452  -0.024917 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032307   0.015935    0.01944   0.061411 
Dimensionality of Krylov space: 215

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193723  -0.177021  -0.142453  -0.024954 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032309   0.015936   0.019442   0.061418 
Dimensionality of Krylov space: 220

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193723  -0.177021  -0.142454  -0.024980 

Residual maximum components:

         1          2          3          4          5 
 0.000119c    0.03231   0.015937   0.019444   0.061442 
Dimensionality of Krylov space: 225

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193724  -0.177021  -0.142454  -0.024994 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032312   0.015936   0.019445   0.061425 
Dimensionality of Krylov space: 230

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193724  -0.177021  -0.142454  -0.024998 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032316   0.015935   0.019446   0.061417 
Dimensionality of Krylov space: 235

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193725  -0.177021  -0.142454  -0.025020 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032313   0.015939   0.019447   0.061389 
Dimensionality of Krylov space: 240

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193726  -0.177021  -0.142455  -0.025052 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032311   0.015938   0.019453   0.061382 
Dimensionality of Krylov space: 245

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193726  -0.177021  -0.142455  -0.025069 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032307   0.015977   0.019472   0.061368 
Dimensionality of Krylov space: 250

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193726  -0.177022  -0.142455  -0.025083 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032299   0.016006   0.019487   0.061723 
Dimensionality of Krylov space: 255

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193726  -0.177022  -0.142455  -0.025094 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032287   0.015999   0.019498   0.062155 
Dimensionality of Krylov space: 260

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193726  -0.177022  -0.142455  -0.025108 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032279   0.016005   0.019508   0.062118 
Dimensionality of Krylov space: 265

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193726  -0.177022  -0.142455  -0.025118 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032282   0.016007   0.019506   0.062318 
Dimensionality of Krylov space: 270

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193726  -0.177022  -0.142455  -0.025152 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032286   0.016007   0.019509   0.062547 
Dimensionality of Krylov space: 275

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193727  -0.177022  -0.142455  -0.025170 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032291   0.015996   0.019502   0.062832 
Dimensionality of Krylov space: 280

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193728  -0.177022  -0.142456  -0.025189 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032297   0.015997   0.019506   0.062677 
Dimensionality of Krylov space: 285

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193728  -0.177023  -0.142456  -0.025215 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032297      0.016    0.01951   0.062552 
Dimensionality of Krylov space: 290

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193728  -0.177023  -0.142457  -0.025220 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032298      0.016   0.019511   0.062579 
Dimensionality of Krylov space: 295

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193728  -0.177023  -0.142457  -0.025242 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032298      0.016   0.019512    0.06253 
Krylov space exceeded maximum size. Partial diagonalization is not fully converged. Current size is 300. Size at next step would be 305.
Dimensionality of Krylov space: 300

Eigenvalues:

         1          2          3          4          5 
 -0.969519  -0.193728  -0.177023  -0.142457  -0.025257 

Residual maximum components:

         1          2          3          4          5 
 0.000119c   0.032301   0.016003   0.019511    0.06253 
Using target saddle point order of 5.
|-------------------------------------------------------|
|             Davidson partial diagonalizer             |
|-------------------------------------------------------|

Davidson will target the 5 lowest eigenpairs as recovered from previous calculation.
Dimensionality of Krylov space: 5

Eigenvalues:

         1          2          3          4          5 
 -0.698860  -0.139943  -0.048704  -0.023482   0.040679 

Residual maximum components:

         1          2          3          4          5 
   0.12691    0.05579    0.06969   0.083532   0.074447 
Dimensionality of Krylov space: 10

Eigenvalues:

         1          2          3          4          5 
 -0.709379  -0.149900  -0.068244  -0.030367   0.010910 

Residual maximum components:

         1          2          3          4          5 
  0.044623   0.050023   0.081948   0.079407   0.072638 
Dimensionality of Krylov space: 15

Eigenvalues:

         1          2          3          4          5 
 -0.711788  -0.152635  -0.079572  -0.061145   0.001425 

Residual maximum components:

         1          2          3          4          5 
  0.025662   0.045811   0.083051   0.100732   0.027373 
Dimensionality of Krylov space: 20

Eigenvalues:

         1          2          3          4          5 
 -0.712552  -0.157946  -0.088542  -0.081821  -0.002563 

Residual maximum components:

         1          2          3          4          5 
  0.012195   0.025112   0.038698   0.059968   0.025157 
Dimensionality of Krylov space: 25

Eigenvalues:

         1          2          3          4          5 
 -0.712800  -0.160092  -0.090913  -0.089100  -0.003570 

Residual maximum components:

         1          2          3          4          5 
 0.003437c   0.020783   0.023226   0.036049   0.015669 
Dimensionality of Krylov space: 29

Eigenvalues:

         1          2          3          4          5 
 -0.712805  -0.161077  -0.092020  -0.091720  -0.004075 

Residual maximum components:

         1          2          3          4          5 
 0.003544c   0.012364   0.016639    0.02206  0.009942c 
Dimensionality of Krylov space: 32

Eigenvalues:

         1          2          3          4          5 
 -0.712813  -0.161530  -0.092495  -0.092168  -0.004097 

Residual maximum components:

         1          2          3          4          5 
 0.003301c  0.009584c   0.00832c  0.007222c  0.007741c 
|-------------------------------------------------------|
|             Davidson partial diagonalizer             |
|-------------------------------------------------------|

Davidson will target the 5 lowest eigenpairs as recovered from previous calculation.
Dimensionality of Krylov space: 5

Eigenvalues:

         1          2          3          4          5 
 -0.727988  -0.167636  -0.090888  -0.090747   0.002323 

Residual maximum components:

         1          2          3          4          5 
  0.020988   0.014491   0.010932   0.011816   0.024143 
Dimensionality of Krylov space: 10

Eigenvalues:

         1          2          3          4          5 
 -0.729161  -0.167922  -0.091103  -0.090793   0.000228 

Residual maximum components:

         1          2          3          4          5 
 0.009997c   0.010125  0.009143c     0.0128   0.011513 
Dimensionality of Krylov space: 13

Eigenvalues:

         1          2          3          4          5 
 -0.729213  -0.168082  -0.091165  -0.091075   0.000115 

Residual maximum components:

         1          2          3          4          5 
 0.008941c  0.004141c   0.012379   0.012591   0.011624 
Dimensionality of Krylov space: 16

Eigenvalues:

         1          2          3          4          5 
 -0.729213  -0.168083  -0.091432  -0.091193  -0.000470 

Residual maximum components:

         1          2          3          4          5 
 0.008926c  0.004179c  0.009954c  0.007667c  0.006435c 
|-------------------------------------------------------|
|             Davidson partial diagonalizer             |
|-------------------------------------------------------|

Davidson will target the 5 lowest eigenpairs as recovered from previous calculation.
Dimensionality of Krylov space: 5

Eigenvalues:

         1          2          3          4          5 
 -0.726655  -0.169151  -0.091056  -0.090832   0.000411 

Residual maximum components:

         1          2          3          4          5 
 0.008129c  0.004481c   0.011189  0.007123c  0.006911c 
Dimensionality of Krylov space: 6

Eigenvalues:

         1          2          3          4          5 
 -0.726655  -0.169151  -0.091086  -0.090839   0.000411 

Residual maximum components:

         1          2          3          4          5 
  0.00813c  0.004487c  0.008528c  0.007914c  0.006909c 
|-------------------------------------------------------|
|             Davidson partial diagonalizer             |
|-------------------------------------------------------|

Davidson will target the 5 lowest eigenpairs as recovered from previous calculation.
Dimensionality of Krylov space: 5

Eigenvalues:

         1          2          3          4          5 
 -0.725988  -0.173370  -0.090561  -0.090308   0.000530 

Residual maximum components:

         1          2          3          4          5 
 0.007319c  0.004709c  0.008975c  0.007779c   0.00917c 
|-------------------------------------------------------|
|             Davidson partial diagonalizer             |
|-------------------------------------------------------|

Davidson will target the 5 lowest eigenpairs as recovered from previous calculation.
Dimensionality of Krylov space: 5

Eigenvalues:

         1          2          3          4          5 
 -0.728229  -0.177223  -0.089427  -0.089199   0.000581 

Residual maximum components:

         1          2          3          4          5 
 0.008509c  0.008595c   0.00862c  0.007441c  0.009399c 
|-------------------------------------------------------|
|             Davidson partial diagonalizer             |
|-------------------------------------------------------|

Davidson will target the 5 lowest eigenpairs as recovered from previous calculation.
Dimensionality of Krylov space: 5

Eigenvalues:

         1          2          3          4          5 
 -0.723360  -0.179515  -0.088551  -0.088343   0.000542 

Residual maximum components:

         1          2          3          4          5 
  0.00926c   0.011108  0.008862c  0.008104c   0.00961c 
Dimensionality of Krylov space: 6

Eigenvalues:

         1          2          3          4          5 
 -0.723407  -0.179900  -0.088552  -0.088343   0.000542 

Residual maximum components:

         1          2          3          4          5 
 0.009382c  0.005826c  0.008834c  0.008102c  0.009624c 
|-------------------------------------------------------|
|             Davidson partial diagonalizer             |
|-------------------------------------------------------|

Davidson will target the 5 lowest eigenpairs as recovered from previous calculation.
Dimensionality of Krylov space: 5

Eigenvalues:

         1          2          3          4          5 
 -0.729855  -0.178532  -0.087272  -0.086978   0.000468 

Residual maximum components:

         1          2          3          4          5 
  0.00974c  0.007968c  0.007179c  0.006685c  0.006743c 
|-------------------------------------------------------|
|             Davidson partial diagonalizer             |
|-------------------------------------------------------|

Davidson will target the 5 lowest eigenpairs as recovered from previous calculation.
Dimensionality of Krylov space: 5

Eigenvalues:

         1          2          3          4          5 
 -0.722681  -0.176592  -0.086891  -0.086658   0.000488 

Residual maximum components:

         1          2          3          4          5 
 0.009813c  0.007107c  0.007968c  0.007709c  0.007856c 
|-------------------------------------------------------|
|             Davidson partial diagonalizer             |
|-------------------------------------------------------|

Davidson will target the 5 lowest eigenpairs as recovered from previous calculation.
Dimensionality of Krylov space: 5

Eigenvalues:

         1          2          3          4          5 
 -0.723114  -0.176134  -0.087057  -0.086828   0.000489 

Residual maximum components:

         1          2          3          4          5 
 0.009871c  0.006974c  0.008231c  0.007723c  0.008284c 
|-------------------------------------------------------|
|             Davidson partial diagonalizer             |
|-------------------------------------------------------|

Davidson will target the 5 lowest eigenpairs as recovered from previous calculation.
Dimensionality of Krylov space: 5

Eigenvalues:

         1          2          3          4          5 
 -0.723724  -0.175858  -0.087009  -0.086776   0.000497 

Residual maximum components:

         1          2          3          4          5 
 0.009121c  0.006851c   0.00857c  0.007379c  0.008529c 
|-------------------------------------------------------|
|             Davidson partial diagonalizer             |
|-------------------------------------------------------|

Davidson will target the 5 lowest eigenpairs as recovered from previous calculation.
Dimensionality of Krylov space: 5

Eigenvalues:

         1          2          3          4          5 
 -0.723441  -0.175834  -0.086951  -0.086762   0.000495 

Residual maximum components:

         1          2          3          4          5 
  0.00938c  0.006883c  0.008936c  0.007148c  0.008311c 
|-------------------------------------------------------|
|             Davidson partial diagonalizer             |
|-------------------------------------------------------|

Davidson will target the 5 lowest eigenpairs as recovered from previous calculation.
Dimensionality of Krylov space: 5

Eigenvalues:

         1          2          3          4          5 
 -0.723639  -0.175632  -0.086970  -0.086710   0.000502 

Residual maximum components:

         1          2          3          4          5 
 0.009234c  0.006992c  0.008767c  0.007028c  0.008489c 
|-------------------------------------------------------|
|             Davidson partial diagonalizer             |
|-------------------------------------------------------|

Davidson will target the 5 lowest eigenpairs as recovered from previous calculation.
Dimensionality of Krylov space: 5

Eigenvalues:

         1          2          3          4          5 
 -0.723374  -0.175620  -0.086977  -0.086736   0.000506 

Residual maximum components:

         1          2          3          4          5 
 0.009541c   0.00701c  0.008456c  0.006418c  0.008424c 
|-------------------------------------------------------|
|             Davidson partial diagonalizer             |
|-------------------------------------------------------|

Davidson will target the 5 lowest eigenpairs as recovered from previous calculation.
Dimensionality of Krylov space: 5

Eigenvalues:

         1          2          3          4          5 
 -0.723621  -0.175638  -0.086938  -0.086731   0.000511 

Residual maximum components:

         1          2          3          4          5 
 0.009322c  0.006966c  0.007917c  0.007605c  0.008048c 
|-------------------------------------------------------|
|             Davidson partial diagonalizer             |
|-------------------------------------------------------|

Davidson will target the 5 lowest eigenpairs as recovered from previous calculation.
Dimensionality of Krylov space: 5

Eigenvalues:

         1          2          3          4          5 
 -0.723385  -0.175821  -0.086940  -0.086696   0.000522 

Residual maximum components:

         1          2          3          4          5 
 0.009846c  0.006929c  0.007763c  0.007826c  0.008456c 
Memory usage: 219.02 MiB
Date: Thu Oct  5 14:18:05 2023
