{ "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" [ [ 1.08267 0.385996 1.67532 ] [ 0.7413004 2.189146 0.0242846 ] [ 0.0452684 1.636125 2.5153 ] [ 2.351375 1.598321 0.2166547 ] [ 2.147702 1.718144 2.949578 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08267e-10 3.85996e-11 1.67532e-10 ] [ 7.413004e-11 2.189146e-10 2.42846e-12 ] [ 4.52684e-12 1.636125e-10 2.5153e-10 ] [ 2.351375e-10 1.598321e-10 2.166547e-11 ] [ 2.147702e-10 1.718144e-10 2.949578e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.8446899 -8.1951801 -4.6087817 ] [ -11.7762489 3.8333955 -0.7084306 ] [ -6.8218733 6.1480802 2.8395546 ] [ 12.2699916 -3.2296587 1.5657164 ] [ 3.4834405 1.4433631 0.9119413 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.55769565120589e-09 -1.313012595946541e-08 -7.384082290110879e-09 ] [ -1.886763066830172e-08 6.141776648379927e-09 -1.135030944779316e-09 ] [ -1.092984591131974e-08 9.850310359243389e-09 4.549467993605096e-09 ] [ 1.965869367893239e-08 -5.174483662303322e-09 2.508554210883141e-09 ] [ 5.581086929047863e-09 2.312522614145412e-09 1.461091030401959e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.942096 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.39398768769492e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0923936 0.2180541 1.4228498 ] [ 0.3185635 2.0263203 0.0896187 ] [ -0.0743025 1.9813877 2.5070965 ] [ 2.7122615 1.6734319 0.4720444 ] [ 2.3193998 1.6285379 2.8895279 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0923936e-10 2.180541e-11 1.4228498e-10 ] [ 3.185635e-11 2.0263203e-10 8.96187e-12 ] [ -7.43025e-12 1.9813877e-10 2.5070965e-10 ] [ 2.7122615e-10 1.6734319e-10 4.720444e-11 ] [ 2.3193998e-10 1.6285379e-10 2.8895279e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.46e-05 6.38e-05 2.6e-06 ] [ 5.2e-06 -4.17e-05 -2.3e-06 ] [ 4.08e-05 1.26e-05 -1.91e-05 ] [ -5.61e-05 1.12e-05 5.63e-05 ] [ -1.45e-05 -4.59e-05 -3.74e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.941354487168e-14 1.0221886840704e-13 4.16565921408e-15 ] [ 8.33131842816e-15 -6.681076508736e-14 -3.68500622784e-15 ] [ 6.536880612864e-14 2.018742542208e-14 -3.060157345728e-14 ] [ -8.988210842688002e-14 1.794437815296e-14 9.020254375104e-14 ] [ -2.32315610016e-14 -7.353990689472e-14 -5.992140561792e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.80656 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.333578399127245e-18 } }