{ "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" [ [ 1.875325 2.956791 1.293332 ] [ 2.112421 5.47429 1.464888 ] [ 2.056962 4.106673 3.914817 ] [ 3.228113 2.011758 3.122182 ] [ 3.602336 4.040974 2.324239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.875325e-10 2.956791e-10 1.293332e-10 ] [ 2.112421e-10 5.47429e-10 1.464888e-10 ] [ 2.056962e-10 4.106673e-10 3.914817000000001e-10 ] [ 3.228113e-10 2.011758e-10 3.122182e-10 ] [ 3.602336e-10 4.040974e-10 2.324239e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.9166423 -5.0069465 -8.7999575 ] [ -2.4906752 8.4042179 -3.9152097 ] [ -3.3741646 5.1473985 9.2054991 ] [ 4.2453467 -12.7020121 4.209726 ] [ 6.5361354 4.1573421 -0.7000578 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.87732934589634e-09 -8.022012623896387e-09 -1.409908617053362e-08 ] [ -3.990501575446364e-09 1.346504143548887e-08 -6.272857446869382e-09 ] [ -5.406007636850984e-09 8.24704153464099e-09 1.474883544081544e-08 ] [ 6.801795229930431e-09 -2.035086682373871e-08 6.744724577173901e-09 ] [ 1.047204332826326e-08 6.660796317287576e-09 -1.121616240368682e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.2976047 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.00898750173802e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7643996 2.5861792 1.4048548 ] [ 3.178128 5.5883109 1.10604 ] [ 1.93522 4.4472704 4.5819236 ] [ 4.4223707 2.2506215 2.6027436 ] [ 2.5750386 3.7181041 2.423896 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.643996e-11 2.5861792e-10 1.4048548e-10 ] [ 3.178128e-10 5.5883109e-10 1.10604e-10 ] [ 1.93522e-10 4.4472704e-10 4.5819236e-10 ] [ 4.4223707e-10 2.2506215e-10 2.6027436e-10 ] [ 2.5750386e-10 3.7181041e-10 2.423896e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-06 -1.66e-05 3.3e-06 ] [ 7.7e-06 -1.31e-05 4.77e-05 ] [ 1.89e-05 1.53e-05 -3.86e-05 ] [ -8.9e-06 1.68e-05 -8.8e-06 ] [ -1.57e-05 -2.4e-06 -3.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-15 -2.659613190528e-14 5.28718284864e-15 ] [ 1.233675998016e-14 -2.098851373248e-14 7.642382481215999e-14 ] [ 3.028113813312e-14 2.451330229824e-14 -6.184401756288e-14 ] [ -1.425937192512e-14 2.691656722944e-14 -1.409915426304e-14 ] [ -2.515417294656e-14 -3.84522388992e-15 -5.6076181728e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.595203 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.338409302243002e-18 } }