{ "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" [ [ 0.421878 2.270641 0.131256 ] [ 0.1151872 2.83342 1.501847 ] [ 1.874433 0.2983712 0.2433776 ] [ 2.499725 0.6406393 2.506935 ] [ 1.789352 2.803582 2.39627 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.21878e-11 2.270641e-10 1.31256e-11 ] [ 1.151872e-11 2.83342e-10 1.501847e-10 ] [ 1.874433e-10 2.983712e-11 2.433776e-11 ] [ 2.499725e-10 6.406393e-11 2.506935e-10 ] [ 1.789352e-10 2.803582e-10 2.39627e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 10.9386807 -19.4301215 -46.0189081 ] [ -19.9114224 18.9417203 40.8043092 ] [ -0.4745928 0.8664201 1.0138351 ] [ 0.063076 -0.4273864 -0.9024603 ] [ 9.3842586 0.0493676 5.1032241 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.752569862432676e-08 -3.113048666308103e-08 -7.373041928001333e-08 ] [ -3.190161571898419e-08 3.034798167242347e-08 6.537571076675123e-08 ] [ -7.603814948246351e-10 1.388158039447943e-09 1.624342907949054e-09 ] [ 1.01058893366184e-10 -6.847485037693776e-10 -1.44590080577263e-09 ] [ 1.503523985633355e-08 7.909561519665838e-11 8.176266411085678e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 0.46484084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.447571323769325e-20 } "relaxed-configuration-positions" { "source-value" [ [ 0.2488935 1.8343118 -0.234623 ] [ 0.1796981 3.305561 1.4911439 ] [ 1.8261881 0.2733154 0.237669 ] [ 2.7317479 0.7797623 2.2553649 ] [ 1.7140476 2.6537029 3.0301308 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.488935e-11 1.8343118e-10 -2.34623e-11 ] [ 1.796981e-11 3.305561e-10 1.4911439e-10 ] [ 1.8261881e-10 2.733154e-11 2.37669e-11 ] [ 2.7317479e-10 7.797623000000001e-11 2.2553649e-10 ] [ 1.7140476e-10 2.6537029e-10 3.0301308e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.63e-05 1.46e-05 2.24e-05 ] [ -2.11e-05 -5.9e-06 -5.2e-06 ] [ -3.4e-06 -1.12e-05 -2e-05 ] [ -4.8e-06 3.6e-06 1.92e-05 ] [ 1.3e-05 -1.2e-06 -1.65e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.61154791342e-14 2.33917788564e-14 3.588875660159999e-14 ] [ -3.38059269774e-14 -9.452842140600001e-15 -8.331318496799998e-15 ] [ -5.4474005556e-15 -1.79443783008e-14 -3.204353268e-14 ] [ -7.690447843199998e-15 5.767835882399999e-15 3.076179137279999e-14 ] [ 2.082829624199999e-14 -1.9226119608e-15 -2.6435914461e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.332164 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.296265827545597e-18 } }