{ "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" [ [ -41.714717 -22.2528647 -16.3780942 ] [ -3.4140099 4.8157735 42.1161087 ] [ -12.0322469 -51.1211462 -50.2910278 ] [ 120.3330992 12.9606013 -20.8335471 ] [ -63.1721255 55.5976361 45.3865603 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.683434432068832e-08 -3.565301956816561e-08 -2.624059962050008e-08 ] [ -5.469846844959746e-09 7.715719712768189e-09 6.747744471821148e-08 ] [ -1.927778467887328e-08 -8.190510527013875e-08 -8.057510897716287e-08 ] [ 1.927948782466472e-07 2.076517239437009e-08 -3.337902209195564e-08 ] [ -1.012129025623435e-07 8.90772327311661e-08 7.271728581118943e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 48.649546 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.794516521373416e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0396394 0.1080369 1.2125895 ] [ 0.0455985 1.6916025 2.9124318 ] [ 1.8139594 0.5771416 -0.2118073 ] [ 2.9164816 2.4506446 0.6077018 ] [ 1.82355 3.1394492 2.5385598 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.96394e-12 1.080369e-11 1.2125895e-10 ] [ 4.55985e-12 1.6916025e-10 2.9124318e-10 ] [ 1.8139594e-10 5.771416e-11 -2.118073e-11 ] [ 2.9164816e-10 2.4506446e-10 6.077018e-11 ] [ 1.82355e-10 3.1394492e-10 2.5385598e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.35e-05 -2e-06 1.62e-05 ] [ -5.88e-05 -2.26e-05 -1.4e-05 ] [ -1.71e-05 -1.31e-05 4.6e-06 ] [ 1.93e-05 2.82e-05 -2.39e-05 ] [ 4.31e-05 9.6e-06 1.71e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.16293843808e-14 -3.2043532416e-15 2.595526125696e-14 ] [ -9.420798530304e-14 -3.620919163008e-14 -2.24304726912e-14 ] [ -2.739722021568e-14 -2.098851373248e-14 7.370012455680001e-15 ] [ 3.092200878144e-14 4.518138070656001e-14 -3.829202123712e-14 ] [ 6.905381235648e-14 1.538089555968e-14 2.739722021568e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.435336 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.992360461099259e-18 } }