{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8930763 0.6663194 1.135783 ] [ 0.5039656 2.923467 0.251554 ] [ 2.725001 1.150605 0.7108826 ] [ 2.335544 1.922124 2.540194 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.930763e-11 6.663194e-11 1.135783e-10 ] [ 5.039656000000001e-11 2.923467e-10 2.51554e-11 ] [ 2.725001e-10 1.150605e-10 7.108826e-11 ] [ 2.335544e-10 1.922124e-10 2.540194e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.786021 -0.960232 0.3898158 ] [ -0.0747505 -0.3559665 0.3387565 ] [ 5.2194396 -0.3300102 -3.7811797 ] [ -0.3586681 1.6462087 3.0526074 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.668051016033312e-09 -1.538461273619088e-09 6.24553766324017e-10 ] [ -1.19763504479817e-10 -5.703212087867609e-10 5.427477489156209e-10 ] [ 8.362464169694306e-09 -5.287346314216667e-10 -6.058117764295129e-09 ] [ -5.746496491811753e-10 2.637517113827516e-09 4.890816249055491e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.220672446151738 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.966616040991938e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.7499747 0.6137777 0.3080115 ] [ 0.3639044 2.6728232 1.1848888 ] [ 2.8648846 0.6584284 1.1343294 ] [ 2.4788232 2.717486 2.011184 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.499747e-11 6.137777e-11 3.080115e-11 ] [ 3.639044000000001e-11 2.6728232e-10 1.1848888e-10 ] [ 2.8648846e-10 6.584284e-11 1.1343294e-10 ] [ 2.4788232e-10 2.717486e-10 2.011184e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.2e-05 -2e-07 5e-06 ] [ -9.6e-06 2.03e-05 5.9e-06 ] [ 1.12e-05 -1.38e-05 -3.1e-06 ] [ -1.36e-05 -6.3e-06 -7.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.9226119608e-14 -3.204353268e-16 8.010883169999999e-15 ] [ -1.53808956864e-14 3.252418567019999e-14 9.452842140600001e-15 ] [ 1.79443783008e-14 -2.21100375492e-14 -4.9667475654e-15 ] [ -2.17896022224e-14 -1.00937127942e-14 -1.24969777452e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.97474264615174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.437912296382764e-18 } }