{ "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" [ [ 1.302275 0.3737398 2.647818 ] [ 0.2826825 1.480501 1.727575 ] [ 0.6414777 2.53008 2.452953 ] [ 2.763361 0.4669357 0.177905 ] [ 2.062003 2.101671 0.3497139 ] [ 2.601995 2.989286 1.853157 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.302275e-10 3.737398e-11 2.647818e-10 ] [ 2.826825e-11 1.480501e-10 1.727575e-10 ] [ 6.414777000000001e-11 2.53008e-10 2.452953e-10 ] [ 2.763361e-10 4.669357e-11 1.77905e-11 ] [ 2.062003e-10 2.101671e-10 3.497139e-11 ] [ 2.601995e-10 2.989286e-10 1.853157e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 15.9843556 -19.1498833 12.0967563 ] [ -42.1180867 -66.0044134 -68.4863474 ] [ 20.2407591 83.9369133 58.383128 ] [ 8.1016121 -19.6877975 -0.2341075 ] [ -13.9147646 10.8837667 -16.4069521 ] [ 11.7061244 10.0214143 14.6475227 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.560976105186705e-08 -3.068149556708681e-08 1.938114029105229e-08 ] [ -6.748061437952616e-08 -1.057507288903565e-07 -1.097272255522866e-07 ] [ 3.242927128444286e-08 1.344817612193438e-07 9.354008350143114e-08 ] [ 1.298021360435167e-08 -3.154332912942361e-08 -3.75081566344155e-10 ] [ -2.229391070973035e-08 1.743771669664729e-08 -2.628683528977723e-08 ] [ 1.875527898837727e-08 1.605607583109346e-08 2.346791861592459e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 31.280938 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.011758795320269e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9170129 0.5846294 2.9048938 ] [ 0.1156459 0.8762096 1.0459559 ] [ 0.6057491 2.7847092 2.4296541 ] [ 2.2744602 0.1178157 0.3555271 ] [ 1.748999 2.6671868 0.091978 ] [ 2.9919271 2.9116629 2.3811129 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9170129e-10 5.846294e-11 2.9048938e-10 ] [ 1.156459e-11 8.762096e-11 1.0459559e-10 ] [ 6.057491000000001e-11 2.7847092e-10 2.4296541e-10 ] [ 2.2744602e-10 1.178157e-11 3.555271e-11 ] [ 1.748999e-10 2.6671868e-10 9.197800000000001e-12 ] [ 2.9919271e-10 2.9116629e-10 2.3811129e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-07 2.17e-05 -7.84e-05 ] [ -7.6e-06 -6.4e-05 3.6e-06 ] [ 2.27e-05 -9.7e-06 3.16e-05 ] [ -3.29e-05 8.87e-05 0.0001123 ] [ 3.06e-05 1.82e-05 -7.21e-05 ] [ -1.25e-05 -5.48e-05 3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.806529901999999e-16 3.476723295779999e-14 -1.256106481056e-13 ] [ -1.21765424184e-14 -1.02539304576e-13 5.767835882399999e-15 ] [ 3.636940959179999e-14 -1.55411133498e-14 5.06287816344e-14 ] [ -5.271161125859999e-14 1.421130674358e-13 1.799244359982e-13 ] [ 4.90266050004e-14 2.915961473879999e-14 -1.155169353114e-13 ] [ -2.0027207925e-14 -8.779927954319999e-14 4.806529901999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.677681 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.832276744150575e-18 } }