{ "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" [ [ 1.086446 2.17872 1.239282 ] [ 2.929314 1.55844 2.269162 ] [ 0.8330856 2.151385 3.328528 ] [ 0.5041522 4.058533 2.531522 ] [ 2.750614 3.605463 1.493085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.086446e-10 2.17872e-10 1.239282e-10 ] [ 2.929314e-10 1.55844e-10 2.269162e-10 ] [ 8.330856e-11 2.151385e-10 3.328528e-10 ] [ 5.041522000000001e-11 4.058533e-10 2.531522e-10 ] [ 2.750614e-10 3.605463e-10 1.493085e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.3849078 -8.5810695 -12.7084102 ] [ 8.7303684 -5.5225802 0.4455651 ] [ -5.3655224 -2.5978404 9.753204 ] [ -3.2500648 11.1229931 3.6123768 ] [ 3.2701266 5.5784969 -1.1027358 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.423220140723562e-09 -1.374838893435995e-08 -2.036111770997625e-08 ] [ 1.39875921414511e-08 -8.848148882932988e-09 7.13873986264414e-10 ] [ -8.596514547658706e-09 -4.16219915344972e-09 1.562635542669304e-08 ] [ -5.207177838645028e-09 1.782099949813972e-08 5.787665654480317e-09 ] [ 5.239320385576194e-09 8.937737312385275e-09 -1.766777517679185e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.2287183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.77515359620912e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9529249 2.1462434 1.0724967 ] [ 5.0807496 2.0898745 1.9880883 ] [ -0.4140703 3.1345396 2.4891745 ] [ -0.6466027 4.3372048 4.3163692 ] [ 3.1306103 1.8446787 0.9954503 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.529249e-11 2.1462434e-10 1.0724967e-10 ] [ 5.080749600000001e-10 2.0898745e-10 1.9880883e-10 ] [ -4.140703e-11 3.1345396e-10 2.4891745e-10 ] [ -6.466027e-11 4.3372048e-10 4.316369199999999e-10 ] [ 3.1306103e-10 1.8446787e-10 9.954503000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.2606508 0.1939408 0.2800498 ] [ -0.1503778 -0.0625153 -0.1663944 ] [ 0.0698039 -0.1329717 -0.2311111 ] [ -0.0996327 0.0531772 0.0743457 ] [ 0.4408574 -0.051631 0.04311 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.176086179528167e-10 3.107274155792487e-10 4.486892422197159e-10 ] [ -2.409317954473382e-10 -1.001605521022982e-10 -2.665932175120435e-10 ] [ 1.118381766206611e-10 -2.130441489680314e-10 -3.702808012273709e-10 ] [ -1.596291826071802e-10 8.519926659960577e-11 1.191149423970106e-10 ] [ 7.063314193866739e-10 -8.27219811085248e-11 6.9069834122688e-11 ] ] } "relaxed-potential-energy" { "source-value" -11.018759 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.765399806002959e-18 } }