{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.8178241 -4.5342852 -2.4855126 ] [ -4.1284567 -0.2777227 3.0450342 ] [ -4.5602159 -1.1447488 -0.7783066 ] [ 1.9464378 6.8528792 2.3874557 ] [ 1.7488614 -2.2158899 -6.0122755 ] [ 4.0156661 -1.0752365 3.5724665 ] [ 4.7955314 2.3950038 0.2711382 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.116828565742079e-09 -7.264725799332016e-09 -3.982230211232588e-09 ] [ -6.614516859220747e-09 -4.449608206713918e-10 4.878682644970882e-09 ] [ -7.30627136097528e-09 -1.834089779159539e-09 -1.246984648607984e-09 ] [ 3.118537162694365e-09 1.097952292986461e-08 3.825125737250113e-09 ] [ 2.801984871184527e-09 -3.550247021296596e-09 -9.632727323270665e-09 ] [ 6.433806395365906e-09 -1.722718796323941e-09 5.72372235204776e-09 ] [ 7.683288356693306e-09 3.837219126701209e-09 4.344112886248188e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -18.756198 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.005074217827753e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.047411 0.9333382 2.8942518 ] [ 1.6487924 2.6281543 4.7030692 ] [ 2.2506979 3.4166233 2.3546127 ] [ 3.3169029 4.4815734 4.4108987 ] [ 3.9618842 1.739303 1.4841693 ] [ 4.0378913 2.0692163 4.0109462 ] [ 4.7464733 3.9322336 2.4215091 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.047411e-10 9.333382000000001e-11 2.8942518e-10 ] [ 1.6487924e-10 2.6281543e-10 4.7030692e-10 ] [ 2.2506979e-10 3.4166233e-10 2.3546127e-10 ] [ 3.3169029e-10 4.4815734e-10 4.4108987e-10 ] [ 3.9618842e-10 1.739303e-10 1.4841693e-10 ] [ 4.0378913e-10 2.0692163e-10 4.010946200000001e-10 ] [ 4.7464733e-10 3.9322336e-10 2.4215091e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-07 -0.0 -2.2e-06 ] [ -8.8e-06 -7.1e-06 2.27e-05 ] [ -6.1e-06 -1.63e-05 -1.31e-05 ] [ 1.2e-05 -5.6e-06 1.41e-05 ] [ 9e-06 2.3e-06 -1.92e-05 ] [ -2.44e-05 2.82e-05 9.3e-06 ] [ 1.9e-05 -1.5e-06 -1.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.613059803999998e-16 0.0 -3.5247885948e-15 ] [ -1.40991543792e-14 -1.13754541014e-14 3.636940959179999e-14 ] [ -9.773277467399999e-15 -2.61154791342e-14 -2.09885139054e-14 ] [ 1.9226119608e-14 -8.972189150399999e-15 2.25906905394e-14 ] [ 1.4419589706e-14 3.685006258199999e-15 -3.076179137279999e-14 ] [ -3.909310986959999e-14 4.51813810788e-14 1.49002426962e-14 ] [ 3.0441356046e-14 -2.403264951e-15 -1.85852489544e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.11232 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.542784242753088e-18 } }