{ "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" [ [ 1.107976 2.819188 1.252407 ] [ 2.630591 3.411672 3.024039 ] [ 3.968262 4.362454 1.692316 ] [ 3.394725 3.292047 0.1208017 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.107976e-10 2.819188e-10 1.252407e-10 ] [ 2.630591e-10 3.411672e-10 3.024039e-10 ] [ 3.968262e-10 4.362454e-10 1.692316e-10 ] [ 3.394725e-10 3.292047e-10 1.208017e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 32.1710964 0.1287965 -29.1381762 ] [ -25.7341519 -13.8751831 41.1277561 ] [ 81.5918178 102.4129894 95.3918634 ] [ -88.0287622 -88.6666028 -107.3814433 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.154377851758305e-08 2.063547411408672e-10 -4.668450468039099e-08 ] [ -4.12306565302959e-08 -2.223049397213927e-08 6.589392928938459e-08 ] [ 1.307245029277333e-07 1.640836972829182e-07 1.528346133540272e-07 ] [ -1.410376247548028e-07 -1.420595580519198e-07 -1.720440379630208e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 37.671142 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.035582299123696e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0260947 2.454194 1.1849841 ] [ 2.3225762 3.5874916 3.5198634 ] [ 4.5246892 4.488474 1.8597998 ] [ 3.2281939 3.3552014 -0.4750836 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0260947e-10 2.454194e-10 1.1849841e-10 ] [ 2.3225762e-10 3.5874916e-10 3.5198634e-10 ] [ 4.5246892e-10 4.488474e-10 1.8597998e-10 ] [ 3.2281939e-10 3.3552014e-10 -4.750836e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.1e-06 8.4e-06 1.25e-05 ] [ -1.14e-05 -7.7e-06 1.95e-05 ] [ -7.1e-06 -8e-07 -1.05e-05 ] [ 1.65e-05 1e-07 -2.15e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.36457090368e-15 1.345828361472e-14 2.002720776e-14 ] [ -1.826481347712e-14 -1.233675998016e-14 3.12424441056e-14 ] [ -1.137545400768e-14 -1.28174129664e-15 -1.68228545184e-14 ] [ 2.64359142432e-14 1.6021766208e-16 -3.44467973472e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.3275482 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.494437965542512e-18 } }