{ "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" [ [ 1.235296 0.1194615 1.060663 ] [ 0.5951279 1.958954 0.23753 ] [ 0.7849876 2.237774 2.150251 ] [ 2.634784 1.158802 0.6457174 ] [ 2.006718 1.111823 2.877883 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.235296e-10 1.194615e-11 1.060663e-10 ] [ 5.951279e-11 1.958954e-10 2.3753e-11 ] [ 7.849876000000001e-11 2.237774e-10 2.150251e-10 ] [ 2.634784e-10 1.158802e-10 6.457174e-11 ] [ 2.006718e-10 1.111823e-10 2.877883e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -29.6275166 -38.3556438 6.2428837 ] [ -13.4500699 2.4670881 -20.3231149 ] [ -33.1961193 43.9637379 15.306482 ] [ 54.1971605 17.1671849 -20.1275758 ] [ 22.0765453 -25.2423672 18.901325 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.746851481996712e-08 -6.145251627838697e-08 1.000220239291947e-08 ] [ -2.154938771944671e-08 3.952710907839455e-09 -3.256121982287724e-08 ] [ -5.318604668193643e-08 7.043767360668022e-08 2.452368780914159e-08 ] [ 8.683342418224775e-08 2.750486251833762e-08 -3.224793164582385e-08 ] [ 3.537052503910251e-08 -4.0442730914688e-08 3.028326126664004e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 20.249743 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.244366507910506e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1079656 -0.6030465 1.2743408 ] [ 0.9946529 1.6743266 0.2913146 ] [ 0.9403573 2.8690706 2.4673665 ] [ 3.1575088 2.1025016 -0.6506923 ] [ 1.0564288 0.5439622 3.5897149 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1079656e-10 -6.030465000000001e-11 1.2743408e-10 ] [ 9.946529e-11 1.6743266e-10 2.913146e-11 ] [ 9.403573e-11 2.8690706e-10 2.4673665e-10 ] [ 3.1575088e-10 2.1025016e-10 -6.506923e-11 ] [ 1.0564288e-10 5.439622e-11 3.5897149e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.56e-05 -2.1e-06 4.1e-06 ] [ 7.65e-05 4.4e-05 -3.11e-05 ] [ -3.82e-05 -1.31e-05 7.33e-05 ] [ -4.37e-05 -4.69e-05 -3.67e-05 ] [ -2.02e-05 1.81e-05 -9.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.10157218304e-14 -3.364570931399999e-15 6.568924199399999e-15 ] [ 1.22566512501e-13 7.049577189599999e-14 -4.982769331739999e-14 ] [ -6.12031474188e-14 -2.09885139054e-14 1.174395472722e-13 ] [ -7.001511890579999e-14 -7.514208413459999e-14 -5.879988246779999e-14 ] [ -3.236396800679999e-14 2.899939707539999e-14 -1.53808956864e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196954159838e-18 } }