{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.026325 2.332401 2.957561 ] [ 3.78119 1.739305 1.09586 ] [ 4.095572 1.356929 3.585425 ] [ 3.432411 4.018052 0.5968462 ] [ 4.864307 3.437474 2.341714 ] [ 3.124173 4.42761 2.898506 ] [ 3.279186 3.336979 4.610213 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.026325e-10 2.332401e-10 2.957561e-10 ] [ 3.78119e-10 1.739305e-10 1.09586e-10 ] [ 4.095572e-10 1.356929e-10 3.585425e-10 ] [ 3.432411e-10 4.018052e-10 5.968462e-11 ] [ 4.864307000000001e-10 3.437474e-10 2.341714e-10 ] [ 3.124173e-10 4.42761e-10 2.898506e-10 ] [ 3.279186e-10 3.336979e-10 4.610213e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.3304677 -4.2726785 -2.1250894 ] [ -0.6392287 -3.9809287 -3.7485661 ] [ 3.010277 -5.2157277 2.3561067 ] [ -2.0041107 1.9560552 -6.0985805 ] [ 12.9856114 1.6108568 -1.6146223 ] [ -3.5552624 9.3745423 -0.2724706 ] [ -0.4668187 0.5278806 11.5032223 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.494905721006955e-08 -6.845585600894813e-09 -3.404768553789899e-09 ] [ -1.024157278484377e-09 -6.378150892211737e-09 -6.005864966943435e-09 ] [ 4.822995431531962e-09 -8.356516981398956e-09 3.77489907085024e-09 ] [ -3.210939309035122e-09 3.133945910434268e-09 -9.771003097166774e-09 ] [ 2.080524299187396e-08 2.580877104416702e-09 -2.586910100482324e-09 ] [ -5.696158298089298e-09 1.501967250376066e-08 -4.365460251753485e-10 ] [ -7.479260072922489e-10 8.457579558938765e-10 1.84301938329252e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.5968567 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.967152954707839e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.4048357 1.9648262 2.9294533 ] [ 3.1195991 1.6868789 1.4210351 ] [ 4.6221162 1.8071063 3.3393274 ] [ 3.825683 3.8847481 1.0438335 ] [ 5.7847259 3.3940979 2.1465208 ] [ 2.951281 4.8529624 2.9057891 ] [ 2.8949232 3.0581301 4.3001661 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4048357e-10 1.9648262e-10 2.9294533e-10 ] [ 3.1195991e-10 1.6868789e-10 1.4210351e-10 ] [ 4.6221162e-10 1.8071063e-10 3.3393274e-10 ] [ 3.825683e-10 3.8847481e-10 1.0438335e-10 ] [ 5.7847259e-10 3.3940979e-10 2.1465208e-10 ] [ 2.951281e-10 4.8529624e-10 2.9057891e-10 ] [ 2.8949232e-10 3.0581301e-10 4.3001661e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.08e-05 1.05e-05 -7.3e-06 ] [ 3.19e-05 2e-05 3.06e-05 ] [ -1.33e-05 2.14e-05 -1.1e-05 ] [ -4.47e-05 -2.02e-05 2.98e-05 ] [ 3.6e-06 -3.16e-05 8.2e-06 ] [ -4.4e-06 3.03e-05 -4.6e-06 ] [ 1.61e-05 -3.05e-05 -4.57e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.730350750464e-14 1.68228545184e-14 -1.169588933184e-14 ] [ 5.110943420352001e-14 3.2043532416e-14 4.902660459647999e-14 ] [ -2.130894905664e-14 3.428657968511999e-14 -1.76239428288e-14 ] [ -7.161729494976001e-14 -3.236396774016e-14 4.774486329984001e-14 ] [ 5.76783583488e-15 -5.062878121728e-14 1.313784829056e-14 ] [ -7.04957713152e-15 4.854595161024e-14 -7.370012455680001e-15 ] [ 2.579504359488e-14 -4.88663869344e-14 -7.321947157056e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.23956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.281429012247885e-18 } }