{ "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" [ [ 2.298469 1.653345 1.333865 ] [ 0.8562694 1.609736 3.078689 ] [ 0.6106735 3.571622 1.917701 ] [ 2.573163 3.601998 2.791817 ] [ 3.634663 1.831744 3.381139 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.298469e-10 1.653345e-10 1.333865e-10 ] [ 8.562694e-11 1.609736e-10 3.078689e-10 ] [ 6.106735e-11 3.571622e-10 1.917701e-10 ] [ 2.573163e-10 3.601998e-10 2.791817e-10 ] [ 3.634663e-10 1.831744e-10 3.381139e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5165983 0.9658132 -1.0458874 ] [ 1.7893512 -0.2040095 2.3589722 ] [ -2.7883165 -0.3412521 -2.5802784 ] [ 1.2903713 3.1697633 0.8712328 ] [ -0.8080044 -3.590315 0.3959608 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.276817186050245e-10 1.547403329100035e-09 -1.675696340269298e-09 ] [ 2.866856659040425e-09 -3.268592513210976e-10 3.779490107957143e-09 ] [ -4.467375507690883e-09 -5.467461364189037e-10 -4.134061727635231e-09 ] [ 2.067402729011303e-09 5.078520652729857e-09 1.395868823434122e-09 ] [ -1.294565759183532e-09 -5.752318754307552e-09 6.343991365132647e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -16.018551 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.566454791129246e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3363706 1.8842674 1.2507191 ] [ 1.0937837 1.7824099 3.3615429 ] [ 0.4924291 3.3937419 1.6616867 ] [ 2.5537892 3.6943911 2.8896674 ] [ 3.4968653 1.5136347 3.3395949 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3363706e-10 1.8842674e-10 1.2507191e-10 ] [ 1.0937837e-10 1.7824099e-10 3.3615429e-10 ] [ 4.924291e-11 3.3937419e-10 1.6616867e-10 ] [ 2.5537892e-10 3.6943911e-10 2.8896674e-10 ] [ 3.4968653e-10 1.5136347e-10 3.3395949e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.23e-05 2.2e-06 -1.04e-05 ] [ -2.4e-05 -1.82e-05 -2.7e-06 ] [ 1.65e-05 -6.1e-06 1.14e-05 ] [ 7.4e-06 2.49e-05 -1.04e-05 ] [ 1.24e-05 -2.7e-06 1.21e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.970677243584e-14 3.52478856576e-15 -1.666263685632e-14 ] [ -3.84522388992e-14 -2.915961449856e-14 -4.32587687616e-15 ] [ 2.64359142432e-14 -9.77327738688e-15 1.826481347712e-14 ] [ 1.185610699392e-14 3.989419785791999e-14 -1.666263685632e-14 ] [ 1.986699009792e-14 -4.32587687616e-15 1.938633711168e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }