{ "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" [ [ 0.2609343 1.090408 2.782185 ] [ 0.9561081 2.831858 1.606096 ] [ 1.573969 0.2926919 1.087299 ] [ 2.9831 1.515461 0.0011433 ] [ 2.828068 2.074027 2.745594 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.609343e-11 1.090408e-10 2.782185e-10 ] [ 9.561081000000001e-11 2.831858e-10 1.606096e-10 ] [ 1.573969e-10 2.926919e-11 1.087299e-10 ] [ 2.9831e-10 1.515461e-10 1.1433e-13 ] [ 2.828068e-10 2.074027e-10 2.745594e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1666144 -1.1388518 3.0328577 ] [ 0.3124176 1.9461417 -3.2369661 ] [ -1.5275247 -2.5567513 1.1624414 ] [ 1.9583313 3.3833971 -0.3615194 ] [ 0.4233901 -1.6339357 -0.5968136 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.869122332567929e-09 -1.824641743548841e-09 4.859173741186981e-09 ] [ 5.005481787703584e-10 3.118062758193038e-09 -5.186191450470107e-09 ] [ -2.44736438219786e-09 -4.096367191809124e-09 1.862436449474247e-09 ] [ 3.137592650490844e-09 5.42079977716336e-09 -5.792179354176995e-10 ] [ 6.783457252869233e-10 -2.617853599998434e-09 -9.562008047734222e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.140385 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.945104117476409e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3876522 1.2220611 3.0744693 ] [ 0.9296006 2.7114229 1.180003 ] [ 1.4663629 0.221751 1.0903667 ] [ 3.0532172 1.8997157 0.2144567 ] [ 2.7653465 1.7494952 2.6630216 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.876522e-11 1.2220611e-10 3.0744693e-10 ] [ 9.296006e-11 2.7114229e-10 1.180003e-10 ] [ 1.4663629e-10 2.21751e-11 1.0903667e-10 ] [ 3.0532172e-10 1.8997157e-10 2.144567e-11 ] [ 2.7653465e-10 1.7494952e-10 2.6630216e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.9e-06 6.1e-06 4.4e-06 ] [ -3.2e-06 -1.34e-05 1.38e-05 ] [ -1.32e-05 -7.1e-06 2.2e-06 ] [ 2.75e-05 1.15e-05 -1.49e-05 ] [ -8.2e-06 2.9e-06 -5.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.6463122386e-15 9.773277467399999e-15 7.0495771896e-15 ] [ -5.1269652288e-15 -2.14691668956e-14 2.21100375492e-14 ] [ -2.11487315688e-14 -1.13754541014e-14 3.5247885948e-15 ] [ 4.4059857435e-14 1.8425031291e-14 -2.38724318466e-14 ] [ -1.31378483988e-14 4.6463122386e-15 -8.972189150399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.29999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.291110984443366e-18 } }