{ "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" [ [ 2.8328 1.144076 3.909989 ] [ 1.831555 2.949109 3.983595 ] [ 4.980623 2.123246 2.998848 ] [ 3.28235 2.585733 1.880535 ] [ 4.448764 2.855471 5.04642 ] [ 4.331941 4.016039 3.033368 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8328e-10 1.144076e-10 3.909989e-10 ] [ 1.831555e-10 2.949109e-10 3.983595000000001e-10 ] [ 4.980622999999999e-10 2.123246e-10 2.998848e-10 ] [ 3.28235e-10 2.585733e-10 1.880535e-10 ] [ 4.448764e-10 2.855471e-10 5.04642e-10 ] [ 4.331941e-10 4.016039e-10 3.033368e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.0060753 -22.9628167 7.9785364 ] [ -22.1901886 5.6638373 6.3045894 ] [ 25.8834365 -16.6061453 -6.1408499 ] [ -10.6787108 -0.5443529 -27.4776303 ] [ 9.5654014 3.44963 24.0286134 ] [ 8.4261368 30.9998477 -4.6932591 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.763367653242434e-08 -3.679048806445582e-08 1.27830244882818e-08 ] [ -3.555260138606268e-08 9.074467706074997e-09 1.01010657404235e-08 ] [ 4.146983682626138e-08 -2.660597776126781e-08 -9.838726141622018e-09 ] [ -1.710918078404446e-08 -8.721494898446804e-10 -4.40240168616457e-08 ] [ 1.532546249164759e-08 5.526916536410305e-09 3.84980826197216e-08 ] [ 1.350015938462253e-08 4.966723123330066e-08 -7.519430005376848e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 18.463122 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.958118241537814e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6118903 0.6669004 4.3551286 ] [ 1.3110216 2.2708794 3.1123698 ] [ 4.6747416 1.4299944 3.3477521 ] [ 3.2809046 3.1485973 2.0161726 ] [ 5.5651705 3.2766649 4.6320487 ] [ 4.2643044 4.8806376 3.3892831 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6118903e-10 6.669004e-11 4.355128599999999e-10 ] [ 1.3110216e-10 2.2708794e-10 3.1123698e-10 ] [ 4.6747416e-10 1.4299944e-10 3.3477521e-10 ] [ 3.2809046e-10 3.1485973e-10 2.0161726e-10 ] [ 5.5651705e-10 3.2766649e-10 4.6320487e-10 ] [ 4.2643044e-10 4.880637600000001e-10 3.3892831e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.1e-06 7.6e-06 2.17e-05 ] [ -1.28e-05 1.39e-05 4.8e-06 ] [ 1.94e-05 -1.85e-05 -2.86e-05 ] [ -1.05e-05 -8.9e-06 -4.86e-05 ] [ 2.11e-05 -1.07e-05 4.72e-05 ] [ -2.13e-05 1.67e-05 3.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.568924145279999e-15 1.217654231808e-14 3.476723267136e-14 ] [ -2.050786074624e-14 2.227025502912e-14 7.69044777984e-15 ] [ 3.108222644352e-14 -2.96402674848e-14 -4.582225135488e-14 ] [ -1.68228545184e-14 -1.425937192512e-14 -7.786578377088e-14 ] [ 3.380592669888e-14 -1.714328984256e-14 7.562273650176e-14 ] [ -3.412636202304e-14 2.675634956736e-14 5.44740051072e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.100632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.098952630810435e-18 } }