{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.198213 1.350624 3.055818 ] [ 2.6169 3.019665 1.923407 ] [ 3.04509 0.4771157 2.258597 ] [ 0.8976629 3.617369 3.27072 ] [ 3.817629 1.77083 3.542328 ] [ 3.146341 4.405242 3.880584 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.198213e-10 1.350624e-10 3.055818e-10 ] [ 2.6169e-10 3.019665e-10 1.923407e-10 ] [ 3.04509e-10 4.771157e-11 2.258597e-10 ] [ 8.976629000000001e-11 3.617369e-10 3.27072e-10 ] [ 3.817629e-10 1.77083e-10 3.542328e-10 ] [ 3.146341e-10 4.405242e-10 3.880584e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9117981 -0.3790102 0.8307531 ] [ 0.8966983 0.4443224 -1.2652567 ] [ -0.472944 -3.7674666 -3.8162186 ] [ -0.598053 1.1039742 0.7981566 ] [ 2.3330374 3.5425404 3.7560642 ] [ -0.2469407 -0.9443603 -0.3034986 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.06303821950986e-09 -6.072412814847322e-10 1.331013194477125e-09 ] [ 1.436669052171105e-09 7.11882961377746e-10 -2.027164704050559e-09 ] [ -7.577398197476352e-10 -6.036146906164865e-09 -6.114256220782107e-09 ] [ -9.581865345993023e-10 1.768761653206383e-09 1.278787844257217e-09 ] [ 3.737937977732018e-09 5.67577540711948e-09 6.017878247463855e-09 ] [ -3.956426162639866e-10 -1.513031994271674e-09 -4.862583613655309e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -18.44559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.955309305486227e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3032765 1.2180925 3.6850595 ] [ 2.6321079 3.2708199 1.3823406 ] [ 2.9809978 1.0272175 1.9749466 ] [ 0.9544749 3.4617279 3.0925317 ] [ 3.5998769 1.7096885 4.1946048 ] [ 3.2511019 3.9532995 3.6019709 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3032765e-10 1.2180925e-10 3.6850595e-10 ] [ 2.6321079e-10 3.2708199e-10 1.3823406e-10 ] [ 2.9809978e-10 1.0272175e-10 1.9749466e-10 ] [ 9.544749e-11 3.4617279e-10 3.0925317e-10 ] [ 3.5998769e-10 1.7096885e-10 4.1946048e-10 ] [ 3.2511019e-10 3.9532995e-10 3.6019709e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.86e-05 -1.67e-05 1.72e-05 ] [ 2.8e-05 1.09e-05 3.38e-05 ] [ -2.54e-05 1.59e-05 1.67e-05 ] [ 3.21e-05 -1.53e-05 -7.1e-06 ] [ -2.98e-05 -4.4e-06 -3.08e-05 ] [ -2.36e-05 9.8e-06 -2.97e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.980048514688e-14 -2.675634956736e-14 2.755743787776e-14 ] [ 4.48609453824e-14 1.746372516672e-14 5.415356978304e-14 ] [ -4.069528616832e-14 2.547460827072e-14 2.675634956736e-14 ] [ 5.142986952768e-14 -2.451330229824e-14 -1.137545400768e-14 ] [ -4.774486329984001e-14 -7.04957713152e-15 -4.934703992064001e-14 ] [ -3.781136825088e-14 1.570133088384e-14 -4.758464563776e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.411418 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.27026967169763e-18 } }