{ "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" [ [ 1.222424 2.904477 0.9358623 ] [ 1.494107 1.000567 2.599919 ] [ 2.753047 4.765039 1.902757 ] [ 2.502796 3.18307 3.733295 ] [ 3.53967 2.110225 1.931082 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.222424e-10 2.904477e-10 9.358623e-11 ] [ 1.494107e-10 1.000567e-10 2.599919e-10 ] [ 2.753047e-10 4.765039e-10 1.902757e-10 ] [ 2.502796e-10 3.18307e-10 3.733295e-10 ] [ 3.53967e-10 2.110225e-10 1.931082e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5604402 0.3907006 -3.2278204 ] [ -1.2708026 -1.832654 0.3151711 ] [ -0.1555481 2.3972063 -0.3331256 ] [ 0.7993235 1.0962197 3.8131903 ] [ 3.1874673 -2.0514726 -0.5674155 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.102277427396476e-09 6.259713670525325e-10 -5.171538381021305e-09 ] [ -2.036050215371854e-09 -2.936235392815603e-09 5.049597679718189e-10 ] [ -2.492155292298605e-10 3.840747889094472e-09 -5.337260481099725e-10 ] [ 1.280657424156029e-09 1.75633757460039e-09 6.109404349321338e-09 ] [ 5.106885587624499e-09 -3.28682143793179e-09 -9.090998483795424e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.462805 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.676326155898934e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8272958 3.0923067 0.8910358 ] [ 1.6464096 0.9950702 1.6173892 ] [ 2.0210691 4.7731128 2.0512161 ] [ 3.4697334 3.6934745 3.5790658 ] [ 3.5475361 1.4094138 2.9642084 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.272958000000001e-11 3.0923067e-10 8.910358e-11 ] [ 1.6464096e-10 9.950702e-11 1.6173892e-10 ] [ 2.0210691e-10 4.7731128e-10 2.0512161e-10 ] [ 3.4697334e-10 3.6934745e-10 3.5790658e-10 ] [ 3.5475361e-10 1.4094138e-10 2.9642084e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.5e-06 -7e-07 -1.12e-05 ] [ -4.5e-06 1.21e-05 7e-06 ] [ -6e-07 -2.2e-06 -4.4e-06 ] [ -1.2e-06 -1.11e-05 7.4e-06 ] [ 1.47e-05 1.9e-06 1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.36185012768e-14 -1.12152363456e-15 -1.794437815296e-14 ] [ -7.2097947936e-15 1.938633711168e-14 1.12152363456e-14 ] [ -9.6130597248e-16 -3.52478856576e-15 -7.04957713152e-15 ] [ -1.92261194496e-15 -1.778416049088e-14 1.185610699392e-14 ] [ 2.355199632576e-14 3.04413557952e-15 1.92261194496e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.976835 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.239335826977917e-18 } }