{ "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" [ [ 1.222424 2.904477 0.9358623 ] [ 1.494107 1.000567 2.599919 ] [ 2.753047 4.765039 1.902757 ] [ 2.502796 3.18307 3.733295 ] [ 3.53967 2.110225 1.931082 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.222424e-10 2.904477e-10 9.358623e-11 ] [ 1.494107e-10 1.000567e-10 2.599919e-10 ] [ 2.753047e-10 4.765039e-10 1.902757e-10 ] [ 2.502796e-10 3.18307e-10 3.733295e-10 ] [ 3.53967e-10 2.110225e-10 1.931082e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4590995 0.2937852 -1.0804455 ] [ -1.0064255 -0.515839 0.4636093 ] [ -0.2669095 0.1619923 -0.4025114 ] [ -0.7254339 0.9467954 3.2675105 ] [ 2.4578683 -0.8867339 -2.2481628 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.355584855209696e-10 4.706957789770523e-10 -1.731064520148566e-09 ] [ -1.61247140667695e-09 -8.264651858968513e-10 7.427839816454535e-10 ] [ -4.276361607694176e-10 2.595402758096198e-10 -6.448943546854772e-10 ] [ -1.162273234515765e-09 1.516933454560984e-09 5.235128931318519e-09 ] [ 3.93793912726544e-09 -1.420704323450805e-09 -3.601953877912266e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4631702 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.516167005309126e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3054422 2.8294008 0.7633594 ] [ 1.3712537 1.2101773 2.7155721 ] [ 2.6384965 4.6425141 1.9350849 ] [ 2.544413 3.0951259 3.9435895 ] [ 3.6524385 2.18616 1.7453095 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3054422e-10 2.8294008e-10 7.633594e-11 ] [ 1.3712537e-10 1.2101773e-10 2.7155721e-10 ] [ 2.6384965e-10 4.6425141e-10 1.9350849e-10 ] [ 2.544413e-10 3.0951259e-10 3.9435895e-10 ] [ 3.6524385e-10 2.18616e-10 1.7453095e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.34e-05 7e-06 2.09e-05 ] [ 5e-07 3.6e-06 1.07e-05 ] [ -2.1e-06 -3.6e-06 -2.9e-06 ] [ -1.29e-05 -1.09e-05 -2.63e-05 ] [ 1.2e-06 4e-06 -2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.146916671872e-14 1.12152363456e-14 3.348549137472e-14 ] [ 8.010883104e-16 5.76783583488e-15 1.714328984256e-14 ] [ -3.36457090368e-15 -5.76783583488e-15 -4.646312200320001e-15 ] [ -2.066807840832e-14 -1.746372516672e-14 -4.213724512704e-14 ] [ 1.92261194496e-15 6.4087064832e-15 -3.84522388992e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.43983 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.672645155112647e-18 } }