{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.931726 1.779285 1.793394 ] [ 2.022352 0.7174538 3.630998 ] [ 4.124201 0.9725878 2.711634 ] [ 3.467636 2.844975 3.645464 ] [ 5.471294 3.704408 2.165903 ] [ 3.262896 3.451778 1.529715 ] [ 3.831227 5.45457 3.339943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.931726e-10 1.779285e-10 1.793394e-10 ] [ 2.022352e-10 7.174538e-11 3.630998e-10 ] [ 4.124201e-10 9.725878e-11 2.711634e-10 ] [ 3.467636e-10 2.844975e-10 3.645464e-10 ] [ 5.471294000000001e-10 3.704408e-10 2.165903e-10 ] [ 3.262896e-10 3.451778e-10 1.529715e-10 ] [ 3.831227000000001e-10 5.454570000000001e-10 3.339943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.2515917 -1.3760418 -4.4270978 ] [ -1.5500747 -1.8143816 2.2676483 ] [ 4.2459144 -4.3358069 0.7167443 ] [ 0.9422981 2.2634842 4.5696702 ] [ 2.8230709 0.0245021 -0.8150238 ] [ -0.8831699 3.272532 -3.6175856 ] [ -0.3264471 1.965712 1.3056444 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.413977443727326e-09 -2.20466200120355e-09 -7.092992593155115e-09 ] [ -2.483493444833574e-09 -2.906959780729697e-09 3.633173090456865e-09 ] [ 6.80270478559806e-09 -6.946728447483323e-09 1.148350960551661e-09 ] [ 1.509727985644261e-09 3.626501466790192e-09 7.32141875920646e-09 ] [ 4.523058194840815e-09 3.925669178050368e-11 -1.305812077755575e-09 ] [ -1.414994165974274e-09 5.243174261219866e-09 -5.79601107206274e-09 ] [ -5.230259115479596e-10 3.149417809626009e-09 2.091872932758444e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.668047 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.029644873459558e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7408677 2.1596391 1.536126 ] [ 2.7054493 1.2534522 3.4960666 ] [ 4.9373061 0.8578026 2.8189105 ] [ 2.7827216 3.1325796 4.9310517 ] [ 5.3785619 2.6808194 1.3056391 ] [ 3.3424454 3.88517 1.3114857 ] [ 3.2239801 4.9555947 3.4177713 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7408677e-10 2.1596391e-10 1.536126e-10 ] [ 2.7054493e-10 1.2534522e-10 3.4960666e-10 ] [ 4.9373061e-10 8.578026e-11 2.8189105e-10 ] [ 2.7827216e-10 3.1325796e-10 4.931051700000001e-10 ] [ 5.3785619e-10 2.6808194e-10 1.3056391e-10 ] [ 3.3424454e-10 3.88517e-10 1.3114857e-10 ] [ 3.2239801e-10 4.9555947e-10 3.4177713e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.52e-05 1.92e-05 4e-06 ] [ -2.33e-05 -2.27e-05 1.41e-05 ] [ 1.14e-05 -1.65e-05 2.13e-05 ] [ 1.95e-05 5.4e-06 -4.76e-05 ] [ 6.3e-06 8.2e-06 -8.7e-06 ] [ -2.35e-05 1.56e-05 2.47e-05 ] [ -5.6e-06 -9.3e-06 -7.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.435308463616e-14 3.076179111936e-14 6.4087064832e-15 ] [ -3.733071526464e-14 -3.636940929216e-14 2.259069035328e-14 ] [ 1.826481347712e-14 -2.64359142432e-14 3.412636202304e-14 ] [ 3.12424441056e-14 8.65175375232e-15 -7.626360715008e-14 ] [ 1.009371271104e-14 1.313784829056e-14 -1.393893660096e-14 ] [ -3.76511505888e-14 2.499395528448e-14 3.957376253376001e-14 ] [ -8.972189076479999e-15 -1.490024257344e-14 -1.233675998016e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.442861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.435525057726411e-18 } }