{ "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" [ [ 0.1501776 0.7389508 1.254214 ] [ 0.5251994 1.126951 2.894489 ] [ 1.795844 1.050789 0.3566565 ] [ 2.560887 2.159455 0.963327 ] [ 1.607121 2.890729 1.590789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.501776e-11 7.389508e-11 1.254214e-10 ] [ 5.251994e-11 1.126951e-10 2.894489e-10 ] [ 1.795844e-10 1.050789e-10 3.566565e-11 ] [ 2.560887e-10 2.159455e-10 9.633270000000001e-11 ] [ 1.607121e-10 2.890729e-10 1.590789e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -34.8546077 -18.1062077 -15.9253456 ] [ 0.6702997 6.2954712 34.2319254 ] [ -16.3421318 -49.7319103 -44.7587482 ] [ 118.6391463 7.2816453 -20.3270018 ] [ -68.1127065 54.2610016 46.7791702 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.584323758409567e-08 -2.900934266828894e-08 -2.551521639848015e-08 ] [ 1.073938508269254e-09 1.008645677355972e-08 5.484559056084969e-08 ] [ -2.618298150399222e-08 -7.967930399038272e-08 -7.171141994231408e-08 ] [ 1.900808665135308e-07 1.16664818606182e-08 -3.256744705491952e-08 ] [ -1.091285859337122e-07 8.69357081847114e-08 7.494849283486406e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 38.515775 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.170907423699312e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0404391 0.285023 1.1300103 ] [ 0.2983826 1.5165699 3.0086372 ] [ 1.8183212 0.5875716 -0.1517651 ] [ 2.9697897 2.3315999 0.756363 ] [ 1.5931746 3.2461104 2.3162301 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.04391e-12 2.85023e-11 1.1300103e-10 ] [ 2.983826e-11 1.5165699e-10 3.0086372e-10 ] [ 1.8183212e-10 5.875716e-11 -1.517651e-11 ] [ 2.969789700000001e-10 2.3315999e-10 7.56363e-11 ] [ 1.5931746e-10 3.2461104e-10 2.3162301e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.6e-06 9e-07 2.4e-06 ] [ -2.2e-06 -3.5e-06 4e-07 ] [ 1.6e-06 5e-07 -9e-07 ] [ 1.7e-06 -3e-07 -1.2e-06 ] [ 5e-07 2.3e-06 -7e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.56348259328e-15 1.44195895872e-15 3.84522388992e-15 ] [ -3.52478856576e-15 -5.6076181728e-15 6.408706483200001e-16 ] [ 2.56348259328e-15 8.010883104e-16 -1.44195895872e-15 ] [ 2.72370025536e-15 -4.8065298624e-16 -1.92261194496e-15 ] [ 8.010883104e-16 3.68500622784e-15 -1.12152363456e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.385327 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.3047834601963e-18 } }