{ "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" [ [ 1.247505 0.2174365 0.42208 ] [ 0.0506875 0.0915851 2.362651 ] [ 1.429891 2.603248 1.463699 ] [ 0.6097234 2.164425 2.912732 ] [ 2.744149 0.6540612 0.6213704 ] [ 2.652131 2.68783 0.0915898 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.247505e-10 2.174365e-11 4.2208e-11 ] [ 5.068750000000001e-12 9.15851e-12 2.362651e-10 ] [ 1.429891e-10 2.603248e-10 1.463699e-10 ] [ 6.097234e-11 2.164425e-10 2.912732e-10 ] [ 2.744149e-10 6.540612e-11 6.213704e-11 ] [ 2.652131e-10 2.68783e-10 9.15898e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -33.6443242 -10.0114701 -4.9350569 ] [ -0.2951379 -0.7804155 0.0742509 ] [ -0.050184 4.6269158 -6.2952828 ] [ -8.3647493 -4.0208035 15.8649927 ] [ 33.8858297 7.5846812 5.0570555 ] [ 8.4685657 2.601092 -9.7659594 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.390415009996074e-08 -1.604014346620964e-08 -7.906832852640474e-09 ] [ -4.728630471878286e-10 -1.250363478911427e-09 1.189630570334706e-10 ] [ -8.040363220065599e-11 7.413136382245416e-09 -1.008615500658209e-08 ] [ -1.340180587772786e-08 -6.442037417605419e-09 2.541852060252057e-08 ] [ 5.429108456904323e-08 1.215199899497908e-08 8.102296158941185e-09 ] [ 1.356813808803385e-08 4.167408825284327e-09 -1.564679195927266e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.7779338 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.848563991158829e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8697993 0.3641047 0.48597 ] [ 0.3130068 -0.0184854 2.7108849 ] [ 0.8821963 2.6705773 0.8996657 ] [ 0.3252766 2.2618307 3.1198934 ] [ 3.1657762 0.4301213 0.124353 ] [ 3.1780318 2.7104371 0.5333553 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.697993e-11 3.641047e-11 4.859700000000001e-11 ] [ 3.130068e-11 -1.84854e-12 2.7108849e-10 ] [ 8.821963000000001e-11 2.6705773e-10 8.996657000000001e-11 ] [ 3.252766e-11 2.2618307e-10 3.1198934e-10 ] [ 3.1657762e-10 4.301213e-11 1.24353e-11 ] [ 3.1780318e-10 2.7104371e-10 5.333553e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.79e-05 -9.1e-06 -1.41e-05 ] [ 1.59e-05 1.5e-05 -1.23e-05 ] [ -1.21e-05 -1.92e-05 1.72e-05 ] [ 1e-06 8.8e-06 -1.8e-06 ] [ 7e-07 -1.02e-05 6e-06 ] [ 1.24e-05 1.47e-05 5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.86789617486e-14 -1.45798073694e-14 -2.25906905394e-14 ] [ 2.54746084806e-14 2.403264951e-14 -1.97067725982e-14 ] [ -1.93863372714e-14 -3.076179137279999e-14 2.75574381048e-14 ] [ 1.602176634e-15 1.40991543792e-14 -2.8839179412e-15 ] [ 1.1215236438e-15 -1.63422016668e-14 9.613059803999999e-15 ] [ 1.98669902616e-14 2.35519965198e-14 8.010883169999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.464226 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.637859819409528e-18 } }