{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.256228 0.2353278 1.625271 ] [ 0.7175946 2.735818 1.079118 ] [ 2.902295 0.4260222 2.532348 ] [ 1.615511 1.481432 2.901286 ] [ 2.936652 2.941975 2.695922 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.256228e-10 2.353278e-11 1.625271e-10 ] [ 7.175946e-11 2.735818e-10 1.079118e-10 ] [ 2.902295e-10 4.260222e-11 2.532348e-10 ] [ 1.615511e-10 1.481432e-10 2.901286e-10 ] [ 2.936652e-10 2.941975e-10 2.695922e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.3277897 -16.3470613 -19.3815051 ] [ -3.2640508 3.8658044 -4.3780267 ] [ 30.3057611 -18.0064079 1.0424038 ] [ -20.5708008 17.8282997 22.5124479 ] [ 8.8568801 12.659365 0.2046802 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.455782630587905e-08 -2.619087943364446e-08 -3.105259434713596e-08 ] [ -5.229585880863537e-09 6.193701430265772e-09 -7.014372023978176e-09 ] [ 4.85551819099701e-08 -2.884944576196842e-08 1.670114997793079e-09 ] [ -3.295805611289394e-08 2.856408496795565e-08 3.606891770235806e-08 ] [ 1.419028622944876e-08 2.028253863717379e-08 3.279338311806682e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 10.073061 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.613882283409227e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4526075 0.2805979 0.865201 ] [ 0.8025799 2.6065914 1.4991341 ] [ 2.9687324 0.5216386 2.8344441 ] [ 0.9365968 1.6158787 3.7871856 ] [ 3.2677641 2.7958685 1.8479802 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4526075e-10 2.805979e-11 8.652010000000001e-11 ] [ 8.025799e-11 2.6065914e-10 1.4991341e-10 ] [ 2.9687324e-10 5.216386e-11 2.8344441e-10 ] [ 9.365968e-11 1.6158787e-10 3.7871856e-10 ] [ 3.2677641e-10 2.7958685e-10 1.8479802e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4e-07 0.0 1e-06 ] [ -4e-07 6e-07 -7e-07 ] [ -4e-07 -3e-07 -3e-07 ] [ 3e-07 -5e-07 0.0 ] [ 1e-07 2e-07 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.408706483200001e-16 0.0 1.6021766208e-15 ] [ -6.408706483200001e-16 9.6130597248e-16 -1.12152363456e-15 ] [ -6.408706483200001e-16 -4.8065298624e-16 -4.8065298624e-16 ] [ 4.8065298624e-16 -8.010883104e-16 0.0 ] [ 1.6021766208e-16 3.2043532416e-16 0.0 ] ] } "relaxed-potential-energy" { "source-value" -11.458486 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.835851837896411e-18 } }