{ "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" [ [ 2.101107 2.382088 1.155059 ] [ 1.870329 4.675053 0.5879216 ] [ 2.558831 4.133121 3.113399 ] [ 4.446179 2.802067 2.809564 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.101107e-10 2.382088e-10 1.155059e-10 ] [ 1.870329e-10 4.675053e-10 5.879216e-11 ] [ 2.558831e-10 4.133121e-10 3.113399e-10 ] [ 4.446179e-10 2.802067e-10 2.809564e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2326108 -9.5682198 1.6448151 ] [ -0.9040253 8.8388572 -2.0216651 ] [ -9.8195947 7.9221756 2.3126486 ] [ 9.4910092 -7.1928129 -1.9357985 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.974860206305585e-09 -1.532997806623565e-08 2.635284298758814e-09 ] [ -1.448408200271707e-09 1.416141036042975e-08 -3.239064558307294e-09 ] [ -1.573272505407159e-08 1.269272453219221e-08 3.705271519045851e-09 ] [ 1.520627304803771e-08 -1.152415666616865e-08 -3.101491099279709e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.227488 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.638624216311255e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5366625 2.4187729 1.0750577 ] [ 1.4511823 4.7471451 0.6710216 ] [ 2.6821439 4.4284353 2.9394958 ] [ 4.3064572 2.3979757 2.9803685 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5366625e-10 2.4187729e-10 1.0750577e-10 ] [ 1.4511823e-10 4.7471451e-10 6.710216e-11 ] [ 2.6821439e-10 4.428435300000001e-10 2.9394958e-10 ] [ 4.3064572e-10 2.3979757e-10 2.9803685e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.81e-05 6e-07 5.5e-06 ] [ 3.17e-05 -3.1e-06 -1.55e-05 ] [ -1.14e-05 -2.64e-05 2.13e-05 ] [ 1.78e-05 2.88e-05 -1.13e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.104292925248e-14 9.6130597248e-16 8.8119714144e-15 ] [ 5.078899887936e-14 -4.96674752448e-15 -2.48337376224e-14 ] [ -1.826481347712e-14 -4.229746278912e-14 3.412636202304e-14 ] [ 2.851874385024e-14 4.614268667904e-14 -1.810459581504e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.675149 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03078273929565e-18 } }