{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.030246 0.3236526 0.7484261 ] [ 0.2346781 2.328783 2.431887 ] [ 2.977482 1.327807 0.9963536 ] [ 1.948854 0.1474915 2.662758 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0246e-12 3.236526e-11 7.484261e-11 ] [ 2.346781e-11 2.328783e-10 2.431887e-10 ] [ 2.977482e-10 1.327807e-10 9.963536e-11 ] [ 1.948854e-10 1.474915e-11 2.662758e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.42986 -1.2597655 -0.1429798 ] [ 0.038061 0.35959 1.1184435 ] [ 2.7145414 1.371455 -2.0090154 ] [ -2.3227423 -0.4712795 1.0335518 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.8871164789124e-10 -2.018366848419327e-09 -2.290788946939932e-10 ] [ 6.098044486667399e-11 5.761266958200599e-10 1.791944042149179e-09 ] [ 4.349174803105647e-09 2.19731315558247e-09 -3.218797531226163e-09 ] [ -3.721443439863417e-09 -7.550730029832029e-10 1.655932543988641e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.608484 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.219013528496286e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0349563 -0.3017528 0.562232 ] [ 0.3887817 2.5954091 2.9752584 ] [ 3.3652924 1.325249 0.9946335 ] [ 1.4721423 0.5088289 2.3073008 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.495630000000001e-12 -3.017528e-11 5.62232e-11 ] [ 3.887817e-11 2.5954091e-10 2.9752584e-10 ] [ 3.3652924e-10 1.325249e-10 9.946334999999999e-11 ] [ 1.4721423e-10 5.088289e-11 2.3073008e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 -2e-07 -0.0 ] [ -1e-07 1e-07 2e-07 ] [ 3e-07 -1e-07 -0.0 ] [ -1e-07 2e-07 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.602176634e-16 -3.204353268e-16 0.0 ] [ -1.602176634e-16 1.602176634e-16 3.204353268e-16 ] [ 4.806529901999999e-16 -1.602176634e-16 0.0 ] [ -1.602176634e-16 3.204353268e-16 -3.204353268e-16 ] ] } "relaxed-potential-energy" { "source-value" -9.1471636 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.465537178729532e-18 } }