{ "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" [ [ 1.558502 1.467528 2.474942 ] [ 1.379624 2.873279 4.407553 ] [ 1.24144 3.597751 1.918679 ] [ 3.591005 1.301821 3.64335 ] [ 3.465479 3.687448 2.931727 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.558502e-10 1.467528e-10 2.474942e-10 ] [ 1.379624e-10 2.873279e-10 4.407553e-10 ] [ 1.24144e-10 3.597751e-10 1.918679e-10 ] [ 3.591005e-10 1.301821e-10 3.64335e-10 ] [ 3.465479e-10 3.687448e-10 2.931727e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2146798 -1.9787152 0.5968664 ] [ 0.3732871 -0.1133658 -0.4863379 ] [ 0.4937429 1.5510612 -0.0667223 ] [ -0.236528 1.0549637 -0.3517004 ] [ -0.4158222 -0.513944 0.3078941 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.439549565180199e-10 -3.170251232661596e-09 9.562853918210612e-10 ] [ 5.980718644662316e-10 -1.816320343582887e-10 -7.791992131889684e-10 ] [ 7.910633310659923e-10 2.485073992069993e-09 -1.069009091460038e-10 ] [ -3.789596317645824e-10 1.690238175932665e-09 -5.634861584060083e-10 ] [ -6.662206072496217e-10 -8.234290612004352e-10 4.933007287022573e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.529398 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.007430854829828e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3904331 1.2416454 2.8166609 ] [ 1.1930806 3.1650465 4.2870742 ] [ 1.5303919 3.4544018 1.8673357 ] [ 3.7376489 1.3745924 3.0258085 ] [ 3.3844955 3.692141 3.3793717 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3904331e-10 1.2416454e-10 2.8166609e-10 ] [ 1.1930806e-10 3.1650465e-10 4.2870742e-10 ] [ 1.5303919e-10 3.4544018e-10 1.8673357e-10 ] [ 3.7376489e-10 1.3745924e-10 3.0258085e-10 ] [ 3.3844955e-10 3.692141e-10 3.3793717e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1778577 0.2610097 0.0724921 ] [ 0.1745126 -0.0801217 -0.2505545 ] [ -0.1029851 0.0071268 0.1039384 ] [ -0.0834729 0.1365287 0.0899059 ] [ -0.1659123 -0.3245436 -0.0157818 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.849594487692602e-10 4.181836391420218e-10 1.161451478126957e-10 ] [ 2.796000077550221e-10 -1.283691145587514e-10 -4.014325621362336e-10 ] [ -1.650003195107501e-10 1.141839234111744e-11 1.665276744833587e-10 ] [ -1.337383288503763e-10 2.18743091208217e-10 1.440451310519827e-10 ] [ -2.658208081631559e-10 -5.199761683502668e-10 -2.528523099414144e-11 ] ] } "relaxed-potential-energy" { "source-value" -14.196738 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.274568171522295e-18 } }