{ "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" [ [ 1.724599 2.153048 2.374712 ] [ 0.8645185 3.613019 0.4039649 ] [ 2.279761 4.306527 2.243044 ] [ 4.11856 1.980977 2.568835 ] [ 3.209467 2.952847 0.6643367 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724599e-10 2.153048e-10 2.374712e-10 ] [ 8.645185e-11 3.613019e-10 4.039649e-11 ] [ 2.279761e-10 4.306527e-10 2.243044e-10 ] [ 4.118560000000001e-10 1.980977e-10 2.568835e-10 ] [ 3.209467e-10 2.952847e-10 6.643367000000001e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.7605738 -18.8234677 17.3325847 ] [ -15.9222581 5.0134213 -14.005363 ] [ -3.2458042 25.6726441 11.7898552 ] [ 13.9029602 -10.7112527 6.40176 ] [ 19.0256759 -1.1513449 -21.5188368 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.204686963115302e-08 -3.015851987132395e-08 2.776986198437578e-08 ] [ -2.551026967816343e-08 8.032386397080743e-09 -2.243906516441735e-08 ] [ -5.200351604934447e-09 4.113211017113906e-08 1.888943036405731e-08 ] [ 2.22749977923529e-08 -1.716131865542088e-08 1.025675020397261e-08 ] [ 3.0482493121898e-08 -1.844657881257314e-09 -3.447697722777068e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 11.398119 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.826179978289627e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2023125 2.4599593 3.5624809 ] [ 1.755685 4.2164719 0.2160726 ] [ 0.949987 4.0920752 2.4223107 ] [ 3.7824796 1.5761681 2.0611136 ] [ 3.5064414 2.6617436 -0.0070852 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2023125e-10 2.4599593e-10 3.5624809e-10 ] [ 1.755685e-10 4.2164719e-10 2.160726e-11 ] [ 9.499870000000001e-11 4.0920752e-10 2.4223107e-10 ] [ 3.7824796e-10 1.5761681e-10 2.0611136e-10 ] [ 3.5064414e-10 2.6617436e-10 -7.0852e-13 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.95e-05 -1.1e-06 4.03e-05 ] [ 3.4e-05 2.03e-05 -2.78e-05 ] [ -6.1e-05 3e-06 6.1e-06 ] [ 8e-06 -2.59e-05 2.8e-06 ] [ -1.06e-05 3.7e-06 -2.14e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.72642103136e-14 -1.76239428288e-15 6.456771781824e-14 ] [ 5.44740051072e-14 3.252418540224e-14 -4.454051005824e-14 ] [ -9.773277386880001e-14 4.8065298624e-15 9.77327738688e-15 ] [ 1.28174129664e-14 -4.149637447872e-14 4.48609453824e-15 ] [ -1.698307218048e-14 5.928053496960001e-15 -3.428657968511999e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.566682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853186748062819e-18 } }