{ "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" [ [ 0.9991242 0.9479007 1.187372 ] [ 1.085399 0.1016804 2.948528 ] [ 2.969901 0.5974891 1.991295 ] [ 2.924101 2.886024 0.3835606 ] [ 2.264584 2.996261 2.274235 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.991242000000001e-11 9.479007e-11 1.187372e-10 ] [ 1.085399e-10 1.016804e-11 2.948528e-10 ] [ 2.969901e-10 5.974891e-11 1.991295e-10 ] [ 2.924101e-10 2.886024e-10 3.835606e-11 ] [ 2.264584e-10 2.996261e-10 2.274235e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.6311861 4.3391439 -8.9786826 ] [ -1.7748297 -4.7080344 9.2376561 ] [ 4.2735363 0.2317134 -0.105465 ] [ 1.6825833 -0.2028448 -4.7341586 ] [ -1.5501038 0.3400218 4.5806502 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.21562485439393e-09 6.952074910866933e-09 -1.438543534730376e-08 ] [ -2.843590651241478e-09 -7.543102645602156e-09 1.480035663441051e-08 ] [ 6.846959948000135e-09 3.712457922060787e-10 -1.68973557312672e-10 ] [ 2.695795625808512e-09 -3.249931962108518e-10 -7.58495822807926e-09 ] [ -2.483540068173239e-09 5.447749785223334e-10 7.339010658502844e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.210922399234949 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.54228817845728e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5688502 1.692798 1.2162911 ] [ 1.3435706 -0.1607584 2.438806 ] [ 3.3914554 0.9953181 2.4301754 ] [ 2.7616883 1.9761668 0.3691535 ] [ 2.1775447 3.0258306 2.3305646 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.688502e-11 1.692798e-10 1.2162911e-10 ] [ 1.3435706e-10 -1.607584e-11 2.438806e-10 ] [ 3.3914554e-10 9.953181e-11 2.4301754e-10 ] [ 2.7616883e-10 1.9761668e-10 3.691535e-11 ] [ 2.1775447e-10 3.0258306e-10 2.3305646e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.56e-05 -1.17e-05 -2.7e-06 ] [ 1.1e-05 3.54e-05 3.53e-05 ] [ -5.08e-05 1.6e-06 -3.57e-05 ] [ 8.7e-06 3.44e-05 1.34e-05 ] [ -4.5e-06 -5.97e-05 -1.03e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.703748770048e-14 -1.874546646336e-14 -4.32587687616e-15 ] [ 1.76239428288e-14 5.671705237632e-14 5.655683471424e-14 ] [ -8.139057233664001e-14 2.56348259328e-15 -5.719770536256001e-14 ] [ 1.393893660096e-14 5.511487575552001e-14 2.146916671872e-14 ] [ -7.2097947936e-15 -9.564994426176e-14 -1.650241919424e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.092110399234951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.158460232186793e-19 } }