{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.135873 2.201858 1.32304 ] [ 2.23099 4.042962 2.822852 ] [ 2.191888 4.248584 0.5451371 ] [ 4.0769 3.470441 1.975385 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.135873e-10 2.201858e-10 1.32304e-10 ] [ 2.23099e-10 4.042962e-10 2.822852e-10 ] [ 2.191888e-10 4.248584e-10 5.451371e-11 ] [ 4.0769e-10 3.470441e-10 1.975385e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.112856 -11.7509066 -2.6802957 ] [ -5.3659839 5.4284094 11.224746 ] [ -3.7482482 7.1934736 -10.0868193 ] [ 13.2270881 -0.8709764 1.542369 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.589521727917005e-09 -1.882702782772442e-08 -4.29430710737077e-09 ] [ -8.597253952169205e-09 8.697270628810956e-09 1.798402561561832e-08 ] [ -6.005355634995683e-09 1.152521522426201e-08 -1.616086606069422e-08 ] [ 2.119213131508189e-08 -1.395458025348549e-09 2.471147552446675e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.66774609 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.069847174028613e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.7352996 2.1647059 0.6240254 ] [ 2.582528 4.8172182 2.7091798 ] [ 1.3791449 4.1253904 0.765787 ] [ 3.9386785 2.8565305 2.5674219 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7352996e-10 2.1647059e-10 6.240253999999999e-11 ] [ 2.582528e-10 4.8172182e-10 2.7091798e-10 ] [ 1.3791449e-10 4.1253904e-10 7.657870000000001e-11 ] [ 3.9386785e-10 2.8565305e-10 2.5674219e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.3e-06 -2.11e-05 -1.87e-05 ] [ 8e-07 1.97e-05 2.06e-05 ] [ 7.3e-06 -5.7e-06 5e-07 ] [ -4.8e-06 7e-06 -2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.28718284864e-15 -3.380592669888e-14 -2.996070280896e-14 ] [ 1.28174129664e-15 3.156287942976e-14 3.300483838848e-14 ] [ 1.169588933184e-14 -9.13240673856e-15 8.010883104e-16 ] [ -7.69044777984e-15 1.12152363456e-14 -3.84522388992e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.1407198 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.304287094004365e-18 } }