{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1216963 0.8434563 0.6529034 ] [ 1.22339 2.430398 0.5407666 ] [ 1.204993 2.740018 2.994063 ] [ 2.532779 1.090129 0.1823715 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.216963e-11 8.434563000000001e-11 6.529034e-11 ] [ 1.22339e-10 2.430398e-10 5.407666e-11 ] [ 1.204993e-10 2.740018e-10 2.994063e-10 ] [ 2.532779e-10 1.090129e-10 1.823715e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -19.9501519 -15.4527135 2.3313928 ] [ -5.007803 29.3416359 6.131307 ] [ 0.4532758 -0.0896641 -2.8181978 ] [ 24.504679 -13.7992584 -5.644502 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.19636669555887e-08 -2.475797629762054e-08 3.73530303806145e-09 ] [ -8.023384888172103e-09 4.701048305500597e-08 9.823436730347386e-09 ] [ 7.262278895344166e-10 -1.436577247450733e-10 -4.515250627949994e-09 ] [ 3.926082379400873e-08 -2.210884919285801e-08 -9.043489140458842e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.6304782 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.612314052764067e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.5703459 0.6957717 0.5725358 ] [ 1.1464866 2.3460191 0.6770319 ] [ 1.3522671 2.8779115 2.991444 ] [ 3.1544505 1.184299 0.1290928 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.703459e-11 6.957717e-11 5.725358000000001e-11 ] [ 1.1464866e-10 2.3460191e-10 6.770319e-11 ] [ 1.3522671e-10 2.877911500000001e-10 2.991444e-10 ] [ 3.1544505e-10 1.184299e-10 1.290928e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.5e-05 1.07e-05 -5.4e-06 ] [ 2.1e-05 -2.7e-06 8.17e-05 ] [ -1.35e-05 -1.05e-05 -7.35e-05 ] [ -4.25e-05 2.5e-06 -2.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.6076181728e-14 1.714328984256e-14 -8.65175375232e-15 ] [ 3.36457090368e-14 -4.32587687616e-15 1.3089782991936e-13 ] [ -2.16293843808e-14 -1.68228545184e-14 -1.177599816288e-13 ] [ -6.8092506384e-14 4.005441552e-15 -4.48609453824e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.001145 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.762577732103082e-18 } }