{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.26541 0.4689135 1.770405 ] [ 0.1075881 2.160004 0.6716672 ] [ 0.5668509 2.899878 2.242644 ] [ 2.824031 1.222886 2.646945 ] [ 2.932592 2.399832 0.52394 ] [ 1.820297 2.092873 2.325497 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26541e-10 4.689135e-11 1.770405e-10 ] [ 1.075881e-11 2.160004e-10 6.716672e-11 ] [ 5.668509000000001e-11 2.899878e-10 2.242644e-10 ] [ 2.824031e-10 1.222886e-10 2.646945e-10 ] [ 2.932592e-10 2.399832e-10 5.2394e-11 ] [ 1.820297e-10 2.092873e-10 2.325497e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.6130198 -27.978302 -11.5197707 ] [ -8.9366312 -7.381531 -21.4728874 ] [ -54.5557925 47.959979 14.9868274 ] [ 91.3908448 -67.1821039 32.4849132 ] [ 3.2562784 1.4383659 -4.9560002 ] [ -15.5416797 53.143592 -9.5230824 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.501481530364749e-08 -4.482618135408188e-08 -1.845670729251685e-08 ] [ -1.431806157735185e-08 -1.182651639391044e-08 -3.44033581733509e-08 ] [ -8.7408015272716e-08 7.684035708785896e-08 2.401154448024485e-08 ] [ 1.464242748937212e-07 -1.076375962047365e-07 5.204656845775731e-08 ] [ 5.217133123296031e-09 2.304516217135951e-09 -7.940387653120124e-09 ] [ -2.490051586330196e-08 8.514542064773392e-08 -1.525765997923195e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 42.827907 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.861787131319667e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2346989 0.3183159 1.7889064 ] [ 0.2851022 1.9391725 0.3406952 ] [ 0.0657404 3.3219645 2.2401024 ] [ 3.184622 0.3519869 3.1428721 ] [ 2.457336 2.8397093 0.1606373 ] [ 2.2892695 2.4732373 2.5078848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2346989e-10 3.183159e-11 1.7889064e-10 ] [ 2.851022e-11 1.9391725e-10 3.406952e-11 ] [ 6.574040000000001e-12 3.3219645e-10 2.2401024e-10 ] [ 3.184622e-10 3.519869e-11 3.1428721e-10 ] [ 2.457336e-10 2.8397093e-10 1.606373e-11 ] [ 2.2892695e-10 2.4732373e-10 2.5078848e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0155422 0.1032486 0.0087215 ] [ -0.0894069 0.0053833 -0.1130402 ] [ 0.0815382 -0.1532465 -0.0151491 ] [ -0.0352998 -0.0110473 0.0199002 ] [ -0.0503785 -0.0257184 0.0599858 ] [ 0.1090893 0.0813803 0.0395817 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.490134947579776e-11 1.654224930503309e-10 1.39733833983072e-11 ] [ -1.432456449182035e-10 8.62499740275264e-12 -1.811103656505562e-10 ] [ 1.306385977421146e-10 -2.455279595194272e-10 -2.427153384616128e-11 ] [ -5.655651427891584e-11 -1.769972578296384e-11 3.188363518924416e-11 ] [ -8.071525489097279e-11 -4.120541920438272e-11 9.610784633998465e-11 ] [ 1.747803260394374e-10 1.303856140536902e-10 6.341687435151935e-11 ] ] } "relaxed-potential-energy" { "source-value" -16.901874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.707978737050738e-18 } }