{ "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" [ [ 2.007741 0.810981 1.851579 ] [ 2.28758 2.972606 1.775704 ] [ 2.775609 2.277586 3.884458 ] [ 3.461309 1.568578 0.4572952 ] [ 4.556331 2.173826 2.191246 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.007741e-10 8.10981e-11 1.851579e-10 ] [ 2.28758e-10 2.972606e-10 1.775704e-10 ] [ 2.775609000000001e-10 2.277586e-10 3.884458e-10 ] [ 3.461309e-10 1.568578e-10 4.572952e-11 ] [ 4.556331e-10 2.173826e-10 2.191246e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.7889665 -14.8869023 2.6554448 ] [ -10.0724868 15.6796408 -0.7931956 ] [ -0.2146797 1.5455361 8.8631625 ] [ 6.154781 -3.0093498 -16.0412453 ] [ 14.921352 0.6710753 5.3158337 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.728582988889441e-08 -2.385144682119375e-08 4.254491576384932e-09 ] [ -1.613790286427661e-08 2.512155391230181e-08 -1.270839446041428e-09 ] [ -3.439547963003578e-10 2.476221806022411e-09 1.420035174385128e-08 ] [ 9.861046224344046e-09 -4.821509893369156e-09 -2.570090818817789e-08 ] [ 2.390664132512733e-08 1.075181156456346e-09 8.516904474200762e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.2094271 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.539892444981944e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.9213012 -0.3531113 0.9577007 ] [ 1.7367801 3.4305482 1.8939373 ] [ 3.433646 3.4168776 3.8432262 ] [ 3.1558556 1.6977654 0.8218691 ] [ 4.8409871 1.6114971 2.6435489 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9213012e-10 -3.531113e-11 9.577007e-11 ] [ 1.7367801e-10 3.4305482e-10 1.8939373e-10 ] [ 3.433646e-10 3.4168776e-10 3.8432262e-10 ] [ 3.1558556e-10 1.6977654e-10 8.218691e-11 ] [ 4.840987100000001e-10 1.6114971e-10 2.6435489e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.5e-05 3.3e-05 9.6e-06 ] [ 1.01e-05 -4.16e-05 9.8e-06 ] [ -1.78e-05 -6.9e-06 -3.32e-05 ] [ 3.31e-05 1.41e-05 3.12e-05 ] [ -1.04e-05 1.4e-06 -1.73e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.4032649312e-14 5.28718284864e-14 1.538089555968e-14 ] [ 1.618198387008e-14 -6.665054742528e-14 1.570133088384e-14 ] [ -2.851874385024e-14 -1.105501868352e-14 -5.319226381056e-14 ] [ 5.303204614848e-14 2.259069035328e-14 4.998791056896e-14 ] [ -1.666263685632e-14 2.24304726912e-15 -2.771765553984e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196935810426e-18 } }