{ "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" [ [ 0.8070865 2.620947 2.881943 ] [ 2.981493 2.883992 2.450576 ] [ 2.14387 2.287305 4.61196 ] [ 1.117537 4.809867 2.516966 ] [ 2.97789 5.94727 2.412215 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.070865000000001e-11 2.620947e-10 2.881943e-10 ] [ 2.981493e-10 2.883992e-10 2.450576e-10 ] [ 2.14387e-10 2.287305e-10 4.61196e-10 ] [ 1.117537e-10 4.809867e-10 2.516966e-10 ] [ 2.97789e-10 5.947269999999999e-10 2.412215e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.0183921 -1.5806462 -1.3943161 ] [ 4.9524869 -0.3015727 -1.8625948 ] [ 1.6803303 -1.2766279 3.9303099 ] [ -1.902229 1.9528532 -0.6009045 ] [ 1.2878039 1.2059936 -0.0724945 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.642527117427416e-09 -2.532474387396361e-09 -2.233940657425035e-09 ] [ 7.934758725998269e-09 -4.831727294115322e-10 -2.984205842583652e-09 ] [ 2.69218592188185e-09 -2.045383374841001e-09 6.297050634278786e-09 ] [ -3.047706831207763e-09 3.128815740894467e-09 -9.627551412335136e-10 ] [ 2.063289300755061e-09 1.932214750754427e-09 -1.161489930365856e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.0206129 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.285043847286689e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1512294 2.9766356 2.8038452 ] [ 3.2683225 1.6658938 2.5774441 ] [ 2.1683353 1.8879437 4.8117399 ] [ 0.8860214 5.2287296 2.4494514 ] [ 2.5539679 6.7901783 2.2311794 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1512294e-10 2.9766356e-10 2.8038452e-10 ] [ 3.2683225e-10 1.6658938e-10 2.5774441e-10 ] [ 2.1683353e-10 1.8879437e-10 4.8117399e-10 ] [ 8.860214e-11 5.2287296e-10 2.4494514e-10 ] [ 2.5539679e-10 6.7901783e-10 2.2311794e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.91e-05 -7e-06 9.2e-06 ] [ -1.9e-06 -1.17e-05 -2e-06 ] [ -7.3e-06 2.4e-06 -4.7e-06 ] [ -1.76e-05 2e-07 -2e-07 ] [ 7.7e-06 1.61e-05 -2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.060157345728e-14 -1.12152363456e-14 1.474002491136e-14 ] [ -3.04413557952e-15 -1.874546646336e-14 -3.2043532416e-15 ] [ -1.169588933184e-14 3.84522388992e-15 -7.53023011776e-15 ] [ -2.819830852608e-14 3.2043532416e-16 -3.2043532416e-16 ] [ 1.233675998016e-14 2.579504359488e-14 -3.84522388992e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.141102 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.624783653354812e-18 } }