{ "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" [ [ 0.1724043 0.1217148 2.355607 ] [ 0.0803944 1.628444 0.6781111 ] [ 0.0194903 2.198586 2.964695 ] [ 2.614645 0.684385 2.185781 ] [ 2.191382 2.601245 1.67848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724043e-11 1.217148e-11 2.355607e-10 ] [ 8.03944e-12 1.628444e-10 6.781111e-11 ] [ 1.94903e-12 2.198586e-10 2.964695e-10 ] [ 2.614645e-10 6.84385e-11 2.185781e-10 ] [ 2.191382e-10 2.601245e-10 1.67848e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5729615 -2.5100052 -0.1600706 ] [ 2.7086708 0.7379989 1.2809752 ] [ 2.5477587 1.7813524 -1.0007362 ] [ -2.5273392 -5.5694905 1.317671 ] [ -4.3020518 5.5601444 -1.4378393 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.520162161481591e-09 -4.021471682658497e-09 -2.564613751103604e-10 ] [ 4.339769064958087e-09 1.182404593497703e-09 2.052348534173477e-09 ] [ 4.081959458210215e-09 2.854041192199821e-09 -1.603356156437951e-09 ] [ -4.049243812432253e-09 -8.923307542384975e-09 2.111141687499414e-09 ] [ -6.89264687221764e-09 8.908333439345949e-09 -2.303672529906916e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.98982 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.722069261986588e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1514697 -0.010201 2.558032 ] [ 0.4945626 1.4735513 0.7607589 ] [ 0.0852978 2.2894233 2.8634553 ] [ 2.2886905 0.5867832 1.8784386 ] [ 2.0582954 2.894818 1.8019893 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.514697e-11 -1.0201e-12 2.558032e-10 ] [ 4.945626e-11 1.4735513e-10 7.607589e-11 ] [ 8.52978e-12 2.2894233e-10 2.8634553e-10 ] [ 2.2886905e-10 5.867832e-11 1.8784386e-10 ] [ 2.0582954e-10 2.894818e-10 1.8019893e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.5e-06 -4.57e-05 -1.21e-05 ] [ -9.8e-06 1.18e-05 5.11e-05 ] [ 0.0001072 -9.32e-05 -7.76e-05 ] [ -0.000138 0.0001096 6.36e-05 ] [ 4.42e-05 1.75e-05 -2.5e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.607618218999999e-15 -7.32194721738e-14 -1.93863372714e-14 ] [ -1.57013310132e-14 1.89056842812e-14 8.187122599739999e-14 ] [ 1.717533351648e-13 -1.493228622888e-13 -1.243289067984e-13 ] [ -2.21100375492e-13 1.755985590864e-13 1.018984339224e-13 ] [ 7.08162072228e-14 2.8038091095e-14 -4.005441585e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.467452 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.279247335191657e-18 } }