{ "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" [ [ 2.648062 2.256008 1.840542 ] [ 2.082623 2.792532 4.589039 ] [ 1.893054 0.6019814 4.219017 ] [ 3.79314 0.2675402 2.698761 ] [ 5.137376 2.400602 1.294264 ] [ 4.215429 1.396012 4.868853 ] [ 4.085322 3.344134 3.585876 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.648062e-10 2.256008e-10 1.840542e-10 ] [ 2.082623e-10 2.792532e-10 4.589039e-10 ] [ 1.893054e-10 6.019814000000001e-11 4.219017e-10 ] [ 3.79314e-10 2.675402e-11 2.698761000000001e-10 ] [ 5.137376e-10 2.400602e-10 1.294264e-10 ] [ 4.215429000000001e-10 1.396012e-10 4.868853e-10 ] [ 4.085322e-10 3.344134e-10 3.585876e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.7569607 2.1517981 -2.9364059 ] [ -13.595551 25.5075268 7.3411944 ] [ -6.7498814 -23.3006386 -2.3035365 ] [ 3.3187573 -4.8830378 -3.1241617 ] [ 1.110662 0.4285901 0.5790607 ] [ 10.8515981 -8.3343269 7.5923939 ] [ 8.8213757 8.4300884 -7.148545 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.019314598804403e-09 3.447560608501861e-09 -4.704640882159183e-09 ] [ -2.178247395909406e-08 4.086756309338943e-08 1.176189003642788e-08 ] [ -1.081450217225277e-08 -3.733173841463004e-08 -3.690672325459459e-09 ] [ 5.317235356169333e-09 -7.823489001642667e-09 -5.005458835338783e-09 ] [ 1.77947669001097e-09 6.866770381263341e-10 9.277575155640826e-10 ] [ 1.73861767741377e-08 -1.335306370928454e-08 1.216435600248453e-08 ] [ 1.413340190983324e-08 1.350649054575728e-08 -1.145323167173674e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -17.091114 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.738298327422757e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4949136 2.5734615 1.7739795 ] [ 1.9321103 2.7849845 4.3401017 ] [ 1.9055002 0.165358 4.4939159 ] [ 3.7004041 0.2961207 2.5427595 ] [ 5.1584841 2.2332968 1.4624196 ] [ 4.2788459 1.3824939 4.9334985 ] [ 4.3847478 3.6230942 3.5496773 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4949136e-10 2.5734615e-10 1.7739795e-10 ] [ 1.9321103e-10 2.7849845e-10 4.3401017e-10 ] [ 1.9055002e-10 1.65358e-11 4.4939159e-10 ] [ 3.7004041e-10 2.961207e-11 2.5427595e-10 ] [ 5.1584841e-10 2.2332968e-10 1.4624196e-10 ] [ 4.278845900000001e-10 1.3824939e-10 4.9334985e-10 ] [ 4.384747800000001e-10 3.6230942e-10 3.5496773e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.4e-06 1.57e-05 2e-06 ] [ 1.44e-05 8.03e-05 -3.11e-05 ] [ -8.5e-06 -0.0001041 2.3e-05 ] [ -2.25e-05 1.41e-05 -1.67e-05 ] [ 6.9e-06 -1.9e-05 1.84e-05 ] [ 3.12e-05 2.01e-05 -7.3e-06 ] [ -2.89e-05 -7.2e-06 1.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.185610699392e-14 2.515417294656e-14 3.2043532416e-15 ] [ 2.307134333952e-14 1.2865478265024e-13 -4.982769290688e-14 ] [ -1.36185012768e-14 -1.6678658622528e-13 3.68500622784e-14 ] [ -3.604897396800001e-14 2.259069035328e-14 -2.675634956736e-14 ] [ 1.105501868352e-14 -3.04413557952e-14 2.948004982272e-14 ] [ 4.998791056896e-14 3.220375007808e-14 -1.169588933184e-14 ] [ -4.630290434112001e-14 -1.153567166976e-14 1.858524880128e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.718424 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.960328103582162e-18 } }