Element = Lattice = Model = Element: Ni
Lattice: hcp
Model: EAM_Dynamo_Foiles_1985_Ni__MO_010059867259_000
Computed model cutoff of 4.79999999620023 Angstroms
Computed isolated atomic energy of 0.0 eV for species Ni

==============================================================================
==============================================================================
 Starting optimization to find optimum lattice constant 'a' with c/a fixed to
 sqrt(8/3)
==============================================================================
==============================================================================


Attempting to perform relaxation using initial lattice constant guess of a = 1.0 Angstroms (c/a fixed at sqrt(8/3))

Failed to perform relaxation w.r.t. 'a' with c/a fixed at sqrt(8/3) and an initial guess of a = 1.0 Angstroms
Exception message:
Calling "kim_model.compute" failed.

Continuing...


Attempting to perform relaxation using initial lattice constant guess of a = 1.125 Angstroms (c/a fixed at sqrt(8/3))

Failed to perform relaxation w.r.t. 'a' with c/a fixed at sqrt(8/3) and an initial guess of a = 1.125 Angstroms
Exception message:
Calling "kim_model.compute" failed.

Continuing...


Attempting to perform relaxation using initial lattice constant guess of a = 1.25 Angstroms (c/a fixed at sqrt(8/3))

Failed to perform relaxation w.r.t. 'a' with c/a fixed at sqrt(8/3) and an initial guess of a = 1.25 Angstroms
Exception message:
Calling "kim_model.compute" failed.

Continuing...


Attempting to perform relaxation using initial lattice constant guess of a = 1.375 Angstroms (c/a fixed at sqrt(8/3))

Failed to perform relaxation w.r.t. 'a' with c/a fixed at sqrt(8/3) and an initial guess of a = 1.375 Angstroms
Exception message:
Calling "kim_model.compute" failed.

Continuing...


Attempting to perform relaxation using initial lattice constant guess of a = 1.5 Angstroms (c/a fixed at sqrt(8/3))

Failed to perform relaxation w.r.t. 'a' with c/a fixed at sqrt(8/3) and an initial guess of a = 1.5 Angstroms
Exception message:
Calling "kim_model.compute" failed.

Continuing...


Attempting to perform relaxation using initial lattice constant guess of a = 1.625 Angstroms (c/a fixed at sqrt(8/3))

Failed to perform relaxation w.r.t. 'a' with c/a fixed at sqrt(8/3) and an initial guess of a = 1.625 Angstroms
Exception message:
Calling "kim_model.compute" failed.

Continuing...


Attempting to perform relaxation using initial lattice constant guess of a = 1.75 Angstroms (c/a fixed at sqrt(8/3))

Failed to perform relaxation w.r.t. 'a' with c/a fixed at sqrt(8/3) and an initial guess of a = 1.75 Angstroms
Exception message:
Calling "kim_model.compute" failed.

Continuing...


Attempting to perform relaxation using initial lattice constant guess of a = 1.875 Angstroms (c/a fixed at sqrt(8/3))

Failed to perform relaxation w.r.t. 'a' with c/a fixed at sqrt(8/3) and an initial guess of a = 1.875 Angstroms
Exception message:
Calling "kim_model.compute" failed.

Continuing...


Attempting to perform relaxation using initial lattice constant guess of a = 2.0 Angstroms (c/a fixed at sqrt(8/3))

Failed to perform relaxation w.r.t. 'a' with c/a fixed at sqrt(8/3) and an initial guess of a = 2.0 Angstroms
Exception message:
Calling "kim_model.compute" failed.

Continuing...


Attempting to perform relaxation using initial lattice constant guess of a = 2.125 Angstroms (c/a fixed at sqrt(8/3))

Optimization terminated successfully.
         Current function value: -17.779307
         Iterations: 35
         Function evaluations: 75
Results for this minimization:
  a = 2.4861137406376663, total energy = -17.779307191990682

Attempting to perform relaxation using initial lattice constant guess of a = 2.25 Angstroms (c/a fixed at sqrt(8/3))

Optimization terminated successfully.
         Current function value: -17.779307
         Iterations: 35
         Function evaluations: 79
Results for this minimization:
  a = 2.4861137188039737, total energy = -17.779307191990622

Attempting to perform relaxation using initial lattice constant guess of a = 2.375 Angstroms (c/a fixed at sqrt(8/3))

Optimization terminated successfully.
         Current function value: -17.779307
         Iterations: 33
         Function evaluations: 73
Results for this minimization:
  a = 2.486113743204623, total energy = -17.77930719199071

Attempting to perform relaxation using initial lattice constant guess of a = 2.5 Angstroms (c/a fixed at sqrt(8/3))

Optimization terminated successfully.
         Current function value: -17.779307
         Iterations: 32
         Function evaluations: 68
Results for this minimization:
  a = 2.4861137233674526, total energy = -17.779307191990647

Attempting to perform relaxation using initial lattice constant guess of a = 2.625 Angstroms (c/a fixed at sqrt(8/3))

Optimization terminated successfully.
         Current function value: -17.779307
         Iterations: 34
         Function evaluations: 74
Results for this minimization:
  a = 2.486113713565282, total energy = -17.77930719199068

Attempting to perform relaxation using initial lattice constant guess of a = 2.75 Angstroms (c/a fixed at sqrt(8/3))

Optimization terminated successfully.
         Current function value: -17.779307
         Iterations: 34
         Function evaluations: 76
Results for this minimization:
  a = 2.4861137447180224, total energy = -17.779307191990554

Attempting to perform relaxation using initial lattice constant guess of a = 2.875 Angstroms (c/a fixed at sqrt(8/3))

Optimization terminated successfully.
         Current function value: -17.779307
         Iterations: 34
         Function evaluations: 73
Results for this minimization:
  a = 2.48611372001469, total energy = -17.779307191990636

Attempting to perform relaxation using initial lattice constant guess of a = 3.0 Angstroms (c/a fixed at sqrt(8/3))

Optimization terminated successfully.
         Current function value: -17.779307
         Iterations: 35
         Function evaluations: 75
Results for this minimization:
  a = 2.486113670468329, total energy = -17.779307191990597

Attempting to perform relaxation using initial lattice constant guess of a = 3.125 Angstroms (c/a fixed at sqrt(8/3))

Optimization terminated successfully.
         Current function value: -17.779307
         Iterations: 37
         Function evaluations: 77
Results for this minimization:
  a = 2.4861137161497027, total energy = -17.779307191990657

Attempting to perform relaxation using initial lattice constant guess of a = 3.25 Angstroms (c/a fixed at sqrt(8/3))

Optimization terminated successfully.
         Current function value: -17.779307
         Iterations: 37
         Function evaluations: 79
Results for this minimization:
  a = 2.4861137233674517, total energy = -17.779307191990668

Attempting to perform relaxation using initial lattice constant guess of a = 3.375 Angstroms (c/a fixed at sqrt(8/3))

Failed to perform relaxation w.r.t. 'a' with c/a fixed at sqrt(8/3) and an initial guess of a = 3.375 Angstroms
Exception message:
Calling "kim_model.compute" failed.

Continuing...


Attempting to perform relaxation using initial lattice constant guess of a = 3.5 Angstroms (c/a fixed at sqrt(8/3))

Failed to perform relaxation w.r.t. 'a' with c/a fixed at sqrt(8/3) and an initial guess of a = 3.5 Angstroms
Exception message:
Calling "kim_model.compute" failed.

Continuing...


Attempting to perform relaxation using initial lattice constant guess of a = 3.625 Angstroms (c/a fixed at sqrt(8/3))

Failed to perform relaxation w.r.t. 'a' with c/a fixed at sqrt(8/3) and an initial guess of a = 3.625 Angstroms
Exception message:
Calling "kim_model.compute" failed.

Continuing...


Attempting to perform relaxation using initial lattice constant guess of a = 3.75 Angstroms (c/a fixed at sqrt(8/3))

Failed to perform relaxation w.r.t. 'a' with c/a fixed at sqrt(8/3) and an initial guess of a = 3.75 Angstroms
Exception message:
Calling "kim_model.compute" failed.

Continuing...


Attempting to perform relaxation using initial lattice constant guess of a = 3.875 Angstroms (c/a fixed at sqrt(8/3))

Failed to perform relaxation w.r.t. 'a' with c/a fixed at sqrt(8/3) and an initial guess of a = 3.875 Angstroms
Exception message:
Calling "kim_model.compute" failed.

Continuing...


Attempting to perform relaxation using initial lattice constant guess of a = 4.0 Angstroms (c/a fixed at sqrt(8/3))

Failed to perform relaxation w.r.t. 'a' with c/a fixed at sqrt(8/3) and an initial guess of a = 4.0 Angstroms
Exception message:
Calling "kim_model.compute" failed.

Continuing...


Attempting to perform relaxation using initial lattice constant guess of a = 4.125 Angstroms (c/a fixed at sqrt(8/3))

Optimization terminated successfully.
         Current function value: -17.779307
         Iterations: 36
         Function evaluations: 76
Results for this minimization:
  a = 2.4861137039959442, total energy = -17.779307191990654

Attempting to perform relaxation using initial lattice constant guess of a = 4.25 Angstroms (c/a fixed at sqrt(8/3))

Optimization terminated successfully.
         Current function value: -17.779307
         Iterations: 37
         Function evaluations: 78
Results for this minimization:
  a = 2.486113749642388, total energy = -17.779307191990593

Attempting to perform relaxation using initial lattice constant guess of a = 4.375 Angstroms (c/a fixed at sqrt(8/3))

Failed to perform relaxation w.r.t. 'a' with c/a fixed at sqrt(8/3) and an initial guess of a = 4.375 Angstroms
Exception message:
Calling "kim_model.compute" failed.

Continuing...


Attempting to perform relaxation using initial lattice constant guess of a = 4.5 Angstroms (c/a fixed at sqrt(8/3))

Failed to perform relaxation w.r.t. 'a' with c/a fixed at sqrt(8/3) and an initial guess of a = 4.5 Angstroms
Exception message:
Calling "kim_model.compute" failed.

Continuing...


Attempting to perform relaxation using initial lattice constant guess of a = 4.625 Angstroms (c/a fixed at sqrt(8/3))

Failed to perform relaxation w.r.t. 'a' with c/a fixed at sqrt(8/3) and an initial guess of a = 4.625 Angstroms
Exception message:
Calling "kim_model.compute" failed.

Continuing...


Attempting to perform relaxation using initial lattice constant guess of a = 4.75 Angstroms (c/a fixed at sqrt(8/3))

Failed to perform relaxation w.r.t. 'a' with c/a fixed at sqrt(8/3) and an initial guess of a = 4.75 Angstroms
Exception message:
Calling "kim_model.compute" failed.

Continuing...


Attempting to perform relaxation using initial lattice constant guess of a = 4.875 Angstroms (c/a fixed at sqrt(8/3))

Failed to perform relaxation w.r.t. 'a' with c/a fixed at sqrt(8/3) and an initial guess of a = 4.875 Angstroms
Exception message:
Calling "kim_model.compute" failed.

Continuing...


==============================================================================
==============================================================================
 Starting optimization with both a and c/a relaxed
==============================================================================
==============================================================================


Attempting to perform relaxation using initial lattice constant guess of a = [2.48611374] Angstroms and c = 3.247845393798409 = ([1.30639453] * a) Angstroms

Optimization terminated successfully.
         Current function value: -17.779657
         Iterations: 69
         Function evaluations: 151
Results for this minimization:
  a = 2.4892821518496087, c = 4.049420044437135, total energy = -17.779657427185516

Attempting to perform relaxation using initial lattice constant guess of a = [2.48611374] Angstroms and c = 3.4508357309108093 = ([1.38804419] * a) Angstroms

Optimization terminated successfully.
         Current function value: -17.779657
         Iterations: 73
         Function evaluations: 155
Results for this minimization:
  a = 2.4892820852918094, c = 4.049420080040523, total energy = -17.77965742718555

Attempting to perform relaxation using initial lattice constant guess of a = [2.48611374] Angstroms and c = 3.6538260680232097 = ([1.46969385] * a) Angstroms

Optimization terminated successfully.
         Current function value: -17.779657
         Iterations: 70
         Function evaluations: 147
Results for this minimization:
  a = 2.4892821726624774, c = 4.049420016772649, total energy = -17.779657427185523

Attempting to perform relaxation using initial lattice constant guess of a = [2.48611374] Angstroms and c = 3.85681640513561 = ([1.5513435] * a) Angstroms

Optimization terminated successfully.
         Current function value: -17.779657
         Iterations: 72
         Function evaluations: 152
Results for this minimization:
  a = 2.4892820782561507, c = 4.049419956208908, total energy = -17.77965742718549

Attempting to perform relaxation using initial lattice constant guess of a = [2.48611374] Angstroms and c = 4.059806742248011 = ([1.63299316] * a) Angstroms

Optimization terminated successfully.
         Current function value: -17.779657
         Iterations: 69
         Function evaluations: 145
Results for this minimization:
  a = 2.489282086197362, c = 4.049420052264021, total energy = -17.779657427185548

Attempting to perform relaxation using initial lattice constant guess of a = [2.48611374] Angstroms and c = 4.262797079360411 = ([1.71464282] * a) Angstroms

Optimization terminated successfully.
         Current function value: -17.779657
         Iterations: 66
         Function evaluations: 143
Results for this minimization:
  a = 2.4892821225540596, c = 4.049420021529263, total energy = -17.779657427185615

Attempting to perform relaxation using initial lattice constant guess of a = [2.48611374] Angstroms and c = 4.4657874164728115 = ([1.79629248] * a) Angstroms

Optimization terminated successfully.
         Current function value: -17.779657
         Iterations: 66
         Function evaluations: 142
Results for this minimization:
  a = 2.4892820950962635, c = 4.049420096221671, total energy = -17.779657427185548

Attempting to perform relaxation using initial lattice constant guess of a = [2.48611374] Angstroms and c = 4.668777753585212 = ([1.87794214] * a) Angstroms

Optimization terminated successfully.
         Current function value: -17.779657
         Iterations: 72
         Function evaluations: 153
Results for this minimization:
  a = 2.489282119530711, c = 4.049420006265398, total energy = -17.779657427185526

Attempting to perform relaxation using initial lattice constant guess of a = [2.48611374] Angstroms and c = 4.871768090697612 = ([1.95959179] * a) Angstroms

Optimization terminated successfully.
         Current function value: -17.779657
         Iterations: 70
         Function evaluations: 154
Results for this minimization:
  a = 2.489282146907893, c = 4.049419976280142, total energy = -17.77965742718553

Attempting to perform relaxation using initial lattice constant guess of a = [2.48611374] Angstroms and c = 5.074758427810012 = ([2.04124145] * a) Angstroms

Optimization terminated successfully.
         Current function value: -17.779657
         Iterations: 74
         Function evaluations: 157
Results for this minimization:
  a = 2.4892821231372495, c = 4.049420120221681, total energy = -17.77965742718555

==============================================================================
==============================================================================
 Finished with optimization
==============================================================================
==============================================================================

 Final lattice Constants:
   a = 2.4892821225540596 Angstroms, c = 4.049420021529263 Angstroms, c/a = 1.626742

 Total energy: -17.779657427185615 eV

 Cohesive energy: -4.444914356796404 eV/atom

==============================================================================
==============================================================================