{ "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" [ [ 2.301375 1.527111 2.019819 ] [ 1.794175 5.106546 1.47688 ] [ 0.9503771 3.237781 1.232452 ] [ 3.392468 3.669062 0.7528338 ] [ 3.101246 3.595776 2.776891 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.301375e-10 1.527111e-10 2.019819e-10 ] [ 1.794175e-10 5.106546e-10 1.47688e-10 ] [ 9.503771e-11 3.237781e-10 1.232452e-10 ] [ 3.392468e-10 3.669062e-10 7.528338e-11 ] [ 3.101246e-10 3.595776e-10 2.776891e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9154321 -5.3857632 1.6130018 ] [ -3.2390374 9.046835 -0.199976 ] [ -12.7422169 -4.4188111 -3.8670617 ] [ 9.8545376 1.0191123 -9.1046386 ] [ 7.0421488 -0.2613731 11.5586745 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.466683908549848e-09 -8.628943884204995e-09 2.584313773268317e-09 ] [ -5.189509996176818e-09 1.449462752923517e-08 -3.203968719211008e-10 ] [ -2.041528201434265e-08 -7.079715836151531e-09 -6.195715846931103e-09 ] [ 1.578870975151454e-08 1.632797901029716e-09 -1.458723910575324e-08 ] [ 1.128276616755478e-08 -4.187658701260205e-10 1.851903805133713e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.9223469 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.079939260247356e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.8442278 1.7980169 2.5287069 ] [ 1.6268709 4.8517528 0.5815454 ] [ 0.4556711 3.0959878 1.3390162 ] [ 3.7392678 4.6389194 1.3031078 ] [ 3.8736035 2.7515992 2.5064995 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8442278e-10 1.7980169e-10 2.5287069e-10 ] [ 1.6268709e-10 4.8517528e-10 5.815454e-11 ] [ 4.556711e-11 3.0959878e-10 1.3390162e-10 ] [ 3.7392678e-10 4.6389194e-10 1.3031078e-10 ] [ 3.873603500000001e-10 2.7515992e-10 2.5064995e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.6e-06 2.34e-05 -1.52e-05 ] [ -1.45e-05 -4.2e-06 -6e-07 ] [ -1.8e-06 -3.9e-06 1.6e-06 ] [ 2.8e-06 -2.2e-06 1.1e-06 ] [ 1.5e-05 -1.3e-05 1.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.56348259328e-15 3.749093292672001e-14 -2.435308463616e-14 ] [ -2.32315610016e-14 -6.72914180736e-15 -9.6130597248e-16 ] [ -2.88391791744e-15 -6.24848882112e-15 2.56348259328e-15 ] [ 4.48609453824e-15 -3.52478856576e-15 1.76239428288e-15 ] [ 2.4032649312e-14 -2.08282960704e-14 2.098851373248e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.9680601 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.436841622614931e-18 } }