{ "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" [ [ 0.4656555 2.854978 2.130075 ] [ 2.415045 0.7163998 1.216409 ] [ 1.531563 1.029003 2.475027 ] [ 2.019704 2.428405 0.6522284 ] [ 2.764103 2.749341 2.416687 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.656555e-11 2.854978e-10 2.130075e-10 ] [ 2.415045e-10 7.163998000000001e-11 1.216409e-10 ] [ 1.531563e-10 1.029003e-10 2.475027e-10 ] [ 2.019704e-10 2.428405e-10 6.522284e-11 ] [ 2.764103e-10 2.749341e-10 2.416687e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -34.3412938 -9.6265638 -10.716252 ] [ 175.529689 -62.9428589 -324.4528364 ] [ -204.7346391 32.7606896 383.0612266 ] [ 8.9547921 19.9468068 -141.9511679 ] [ 54.5914519 19.8619264 94.0590297 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.5020818054384e-08 -1.542345545899961e-08 -1.716932841700124e-08 ] [ 2.812295639720949e-07 -1.008455769758932e-07 -5.198307490323273e-07 ] [ -3.280210522339456e-07 5.24884109584057e-08 6.137317415934911e-07 ] [ 1.434715854674454e-08 3.195830751457446e-08 -2.274308425046354e-07 ] [ 8.746514792970774e-08 3.182231412213031e-08 1.506991783604728e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 163.89101 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.62582344581299e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.0007062 2.859203 1.9603809 ] [ 2.3316721 0.1187172 0.6573458 ] [ 1.4927514 0.7234332 3.3475547 ] [ 2.2531818 2.936124 0.0550584 ] [ 3.1191715 3.1406494 2.8700866 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.062e-14 2.859203e-10 1.9603809e-10 ] [ 2.3316721e-10 1.187172e-11 6.573458e-11 ] [ 1.4927514e-10 7.234332e-11 3.3475547e-10 ] [ 2.2531818e-10 2.936124e-10 5.50584e-12 ] [ 3.1191715e-10 3.1406494e-10 2.8700866e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.22e-05 -4.8e-06 -8.4e-06 ] [ 5.7e-06 3.03e-05 2.41e-05 ] [ -7.7e-06 -9.8e-06 6e-07 ] [ -6.9e-06 9e-07 -9.1e-06 ] [ 2.11e-05 -1.66e-05 -7.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.954655477376e-14 -7.69044777984e-15 -1.345828361472e-14 ] [ 9.13240673856e-15 4.854595161024e-14 3.861245656128e-14 ] [ -1.233675998016e-14 -1.570133088384e-14 9.6130597248e-16 ] [ -1.105501868352e-14 1.44195895872e-15 -1.457980724928e-14 ] [ 3.380592669888e-14 -2.659613190528e-14 -1.153567166976e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.133456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.943993953270549e-18 } }