{ "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" [ [ 0.9312002 0.7437347 1.637203 ] [ 0.2868751 2.587784 1.486301 ] [ 2.468756 0.0419283 1.950884 ] [ 2.101698 2.93019 0.1307908 ] [ 2.374683 2.856414 2.678274 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.312002000000001e-11 7.437347e-11 1.637203e-10 ] [ 2.868751e-11 2.587784e-10 1.486301e-10 ] [ 2.468756e-10 4.19283e-12 1.950884e-10 ] [ 2.101698e-10 2.93019e-10 1.307908e-11 ] [ 2.374683e-10 2.856414e-10 2.678274e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.6772715 0.2359783 -3.8819377 ] [ -1.8762067 8.1547761 0.4828391 ] [ 18.0550925 -2.9794567 4.0848807 ] [ 0.368168 -1.7690965 1.8065721 ] [ -0.8697823 -3.6422012 -2.4923542 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.511775787523415e-08 3.780789152761286e-10 -6.219549826342124e-09 ] [ -3.006014510528319e-09 1.30653916152786e-08 7.735935176281133e-10 ] [ 2.892744708988143e-08 -4.77361586742592e-09 6.54470035629714e-09 ] [ 5.898701621266944e-10 -2.834405052239108e-09 2.894447582409559e-09 ] [ -1.393544866245652e-09 -5.835449610889705e-09 -3.993191629992687e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.79155 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.248343924979424e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6628761 0.8012415 1.5965908 ] [ 0.2062442 3.1716233 1.4541413 ] [ 3.0590396 0.4923931 1.6992467 ] [ 2.1615442 2.2823607 0.3434919 ] [ 2.0735082 2.4124324 2.7899821 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.628761e-11 8.012415000000001e-11 1.5965908e-10 ] [ 2.062442e-11 3.1716233e-10 1.4541413e-10 ] [ 3.0590396e-10 4.923931e-11 1.6992467e-10 ] [ 2.1615442e-10 2.2823607e-10 3.434919e-11 ] [ 2.0735082e-10 2.4124324e-10 2.7899821e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.54e-05 2.32e-05 2.19e-05 ] [ -1.46e-05 2.7e-05 -1.53e-05 ] [ -2.18e-05 4.47e-05 -3.05e-05 ] [ 6.4e-06 -4.71e-05 6.72e-05 ] [ -1.54e-05 -4.77e-05 -4.34e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.273881858432e-14 3.717049760256e-14 3.508766799552e-14 ] [ -2.339177866368e-14 4.32587687616e-14 -2.451330229824e-14 ] [ -3.492745033344e-14 7.161729494976001e-14 -4.88663869344e-14 ] [ 1.025393037312e-14 -7.546251883968001e-14 1.0766626891776e-13 ] [ -2.467351996032e-14 -7.642382481215999e-14 -6.953446534272e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }