{ "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" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8296451 1.0733365 0.1006416 ] [ -1.9009394 4.1820991 1.1746082 ] [ -8.5774649 -3.114746 -3.4716398 ] [ 2.4203785 -4.7891599 -0.2295188 ] [ 0.2053202 -0.4139636 0.7684787 ] [ 7.713621 3.725013 0.0030575 ] [ -0.6905605 -0.6625792 1.6543726 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.329237982781278e-09 1.719674646551299e-09 1.612456185999053e-10 ] [ -3.04564066423758e-09 6.700461403888722e-09 1.881929796639971e-09 ] [ -1.374261372851261e-08 -4.990373220930317e-09 -5.562180123398789e-09 ] [ 3.877873846186973e-09 -7.673080025052865e-09 -3.677296553940711e-10 ] [ 3.289592242179802e-10 -6.632428017822029e-10 1.231238606722777e-09 ] [ 1.235858322791192e-08 5.968128740776071e-09 4.898655018096e-12 ] [ -1.106399888347958e-09 -1.061568903668367e-09 2.650597101812111e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.440627 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.473861158989324e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3597846 2.1227963 3.1586061 ] [ 3.0421295 5.4233929 2.8294196 ] [ 2.6354236 3.6040578 1.1633014 ] [ 4.5486473 1.9164875 1.9679461 ] [ 5.4641577 3.2870251 3.8480593 ] [ 5.087654 4.5237152 1.7079215 ] [ 3.2355064 3.8280162 4.652719 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3597846e-10 2.1227963e-10 3.1586061e-10 ] [ 3.0421295e-10 5.4233929e-10 2.8294196e-10 ] [ 2.6354236e-10 3.6040578e-10 1.1633014e-10 ] [ 4.5486473e-10 1.9164875e-10 1.9679461e-10 ] [ 5.4641577e-10 3.2870251e-10 3.8480593e-10 ] [ 5.087654e-10 4.5237152e-10 1.7079215e-10 ] [ 3.2355064e-10 3.8280162e-10 4.652719e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.8e-06 9.2e-06 -5e-07 ] [ 6e-06 -7.3e-06 7.1e-06 ] [ 9.6e-06 -2.1e-06 8e-07 ] [ 1.6e-06 3e-06 -3e-07 ] [ -1.22e-05 -4e-07 -5.9e-06 ] [ -1.14e-05 -5.3e-06 -2e-06 ] [ -2.4e-06 2.7e-06 9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.409915426304e-14 1.474002491136e-14 -8.010883104e-16 ] [ 9.6130597248e-15 -1.169588933184e-14 1.137545400768e-14 ] [ 1.538089555968e-14 -3.36457090368e-15 1.28174129664e-15 ] [ 2.56348259328e-15 4.8065298624e-15 -4.8065298624e-16 ] [ -1.954655477376e-14 -6.408706483200001e-16 -9.45284206272e-15 ] [ -1.826481347712e-14 -8.491536090240001e-15 -3.2043532416e-15 ] [ -3.84522388992e-15 4.32587687616e-15 1.44195895872e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.651699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148549269679874e-18 } }