{ "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" [ [ 0.9066893 0.9379891 0.1369545 ] [ 0.7550462 2.78121 2.963246 ] [ 2.797941 0.0158314 0.1688765 ] [ 2.09203 0.1495358 1.796908 ] [ 2.487588 2.015226 1.460751 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.066893000000001e-11 9.379891e-11 1.369545e-11 ] [ 7.550462e-11 2.78121e-10 2.963246e-10 ] [ 2.797941e-10 1.58314e-12 1.688765e-11 ] [ 2.09203e-10 1.495358e-11 1.796908e-10 ] [ 2.487588e-10 2.015226e-10 1.460751e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -17.7127119 3.9697528 -11.2624912 ] [ 0.0088169 0.3517185 0.0307451 ] [ 16.2911683 -12.4684119 -21.3331803 ] [ -4.4686567 -14.1747814 25.8313976 ] [ 5.8813834 22.3217221 6.7335288 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.837889289714595e-08 6.360245126515338e-09 -1.804450009260574e-08 ] [ 1.412623104793152e-11 5.635151578028448e-10 4.925908042415808e-11 ] [ 2.610132897577808e-08 -1.997659804468451e-08 -3.417952272397113e-08 ] [ -7.15957729112128e-09 -2.271050336403069e-08 4.138646131730923e-08 ] [ 9.423014981441215e-09 3.576334128461468e-08 1.078830241884348e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 7.382376 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.182787023315502e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7052339 1.4889102 -0.6685937 ] [ 1.6188397 2.058035 3.0929954 ] [ 2.2152007 -0.5500239 0.386827 ] [ 2.1630572 -0.197984 2.7116062 ] [ 1.3369631 3.100855 1.0039011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7052339e-10 1.4889102e-10 -6.685937e-11 ] [ 1.6188397e-10 2.058035e-10 3.0929954e-10 ] [ 2.2152007e-10 -5.500239e-11 3.86827e-11 ] [ 2.1630572e-10 -1.97984e-11 2.7116062e-10 ] [ 1.3369631e-10 3.100855e-10 1.0039011e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7e-06 1.8e-06 -4.06e-05 ] [ 5.49e-05 -6.8e-06 -2e-07 ] [ 4.08e-05 -5.4e-06 3.66e-05 ] [ -6.1e-05 1.49e-05 -2.41e-05 ] [ -2.77e-05 -4.5e-06 2.83e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.12152363456e-14 2.88391791744e-15 -6.504837080448e-14 ] [ 8.795949648192e-14 -1.089480102144e-14 -3.2043532416e-16 ] [ 6.536880612864e-14 -8.65175375232e-15 5.863966432128e-14 ] [ -9.773277386880001e-14 2.387243164992e-14 -3.861245656128e-14 ] [ -4.438029239616e-14 -7.2097947936e-15 4.534159836864e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.57084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853852933101747e-18 } }