{ "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" [ [ 1.26846 0.3454837 2.901552 ] [ 0.267977 2.35609 2.023372 ] [ 2.685563 0.3914351 1.602855 ] [ 2.683655 1.904541 0.876934 ] [ 1.547568 2.030572 0.3165864 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26846e-10 3.454837e-11 2.901552e-10 ] [ 2.67977e-11 2.35609e-10 2.023372e-10 ] [ 2.685563e-10 3.914351e-11 1.602855e-10 ] [ 2.683655e-10 1.904541e-10 8.769340000000001e-11 ] [ 1.547568e-10 2.030572e-10 3.165864e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.9390509 -2.7986746 8.8642772 ] [ -6.870011 2.8066889 4.9092906 ] [ 10.4120885 -23.0382474 5.9543739 ] [ 29.4372447 15.5863495 1.9407978 ] [ -26.0402713 7.4438835 -21.6687395 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.11175851225212e-08 -4.483971013346791e-09 1.420213769013049e-08 ] [ -1.100697100883883e-08 4.496811337438869e-09 7.865550624033205e-09 ] [ 1.668200476840054e-08 -3.691134136848638e-08 9.539958654081718e-09 ] [ 4.716366523910871e-08 2.497208477251777e-08 3.109500860860074e-09 ] [ -4.172111387614923e-08 1.192641611165888e-08 -3.471714782910548e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 10.045388 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.609448580046487e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0572735 0.3675012 3.0570219 ] [ -0.1141125 1.9879697 1.9578266 ] [ 3.1039564 0.1816836 2.0656316 ] [ 3.1974933 1.6873159 0.3537278 ] [ 1.2086122 2.8036515 0.2870916 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0572735e-10 3.675012e-11 3.0570219e-10 ] [ -1.141125e-11 1.9879697e-10 1.9578266e-10 ] [ 3.1039564e-10 1.816836e-11 2.0656316e-10 ] [ 3.1974933e-10 1.6873159e-10 3.537278e-11 ] [ 1.2086122e-10 2.8036515e-10 2.870916e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8e-07 4e-07 -9e-07 ] [ 6e-07 -2.1e-06 7e-07 ] [ -1.6e-06 -2e-07 2.5e-06 ] [ -1e-06 3e-07 -1.9e-06 ] [ 1.2e-06 1.7e-06 -4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.28174129664e-15 6.408706483200001e-16 -1.44195895872e-15 ] [ 9.6130597248e-16 -3.36457090368e-15 1.12152363456e-15 ] [ -2.56348259328e-15 -3.2043532416e-16 4.005441552e-15 ] [ -1.6021766208e-15 4.8065298624e-16 -3.04413557952e-15 ] [ 1.92261194496e-15 2.72370025536e-15 -6.408706483200001e-16 ] ] } "relaxed-potential-energy" { "source-value" -12.078032 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.935114049567427e-18 } }