{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.6618616 0.5532969 2.6678 ] [ 1.355444 2.726321 1.335983 ] [ 0.8455628 2.30582 2.977156 ] [ 2.930365 0.9373095 0.4139469 ] [ 2.829062 1.427351 2.413715 ] [ 2.781652 2.87748 1.992398 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.618616000000001e-11 5.532969e-11 2.6678e-10 ] [ 1.355444e-10 2.726321e-10 1.335983e-10 ] [ 8.455628e-11 2.30582e-10 2.977156e-10 ] [ 2.930365e-10 9.373095e-11 4.139469e-11 ] [ 2.829062e-10 1.427351e-10 2.413715e-10 ] [ 2.781652e-10 2.87748e-10 1.992398e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.6618568 -196.8935729 -38.6742452 ] [ -1077.9111997 -69.69541 -754.8766726 ] [ -47.0958705 143.52904 260.7856914 ] [ -2.8156083 1.7446225 -10.7450568 ] [ 66.953285 -2204.5136855 657.3233468 ] [ 1076.5312503 2325.829006 -113.8130637 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.50930608032775e-08 -3.154582792861605e-07 -6.196297148652662e-08 ] [ -1.72700412345782e-06 -1.116643564790705e-07 -1.209445756427016e-06 ] [ -7.545590265132441e-08 2.29958872293868e-07 4.178247378002437e-07 ] [ -4.511101791590434e-09 2.795193381621648e-09 -1.721547879412806e-08 ] [ 1.072709879127593e-07 -3.532020287141744e-06 1.05314809854897e-06 ] [ 1.724793200791253e-06 3.726388857391703e-06 -1.823486298017611e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 420.40241 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.735589126299762e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.3922161 0.6132933 2.6098935 ] [ 1.1513493 2.0337968 1.0987313 ] [ 1.2075382 2.5765406 3.2463871 ] [ 3.1866799 1.4960527 0.4309067 ] [ 2.5640512 0.9960429 2.4900422 ] [ 2.9021127 3.1118522 1.9250381 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.922161e-11 6.132933000000001e-11 2.6098935e-10 ] [ 1.1513493e-10 2.0337968e-10 1.0987313e-10 ] [ 1.2075382e-10 2.5765406e-10 3.2463871e-10 ] [ 3.1866799e-10 1.4960527e-10 4.309067e-11 ] [ 2.5640512e-10 9.960429e-11 2.4900422e-10 ] [ 2.9021127e-10 3.1118522e-10 1.9250381e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.43e-05 -1.33e-05 -3e-06 ] [ 4.86e-05 -1.04e-05 -5.6e-05 ] [ -3e-07 1.84e-05 5.5e-05 ] [ -4.8e-06 3.19e-05 -0.0001012 ] [ -6.99e-05 3.45e-05 9.74e-05 ] [ -7.9e-06 -6.12e-05 7.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.495465809344e-14 -2.130894905664e-14 -4.8065298624e-15 ] [ 7.786578377088e-14 -1.666263685632e-14 -8.97218907648e-14 ] [ -4.8065298624e-16 2.948004982272e-14 8.8119714144e-14 ] [ -7.69044777984e-15 5.110943420352001e-14 -1.6214027402496e-13 ] [ -1.1199214579392e-13 5.52750934176e-14 1.5605200286592e-13 ] [ -1.265719530432e-14 -9.805320919295999e-14 1.249697764224e-14 ] ] } "relaxed-potential-energy" { "source-value" -39.006818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.249581185140063e-18 } }