{ "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" [ [ 0.9163946 0.5446671 1.49786 ] [ 0.0084298 2.294234 2.779305 ] [ 1.912564 0.4098673 0.1717336 ] [ 2.851379 0.2549877 2.412214 ] [ 1.718971 2.318251 1.204915 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.163945999999999e-11 5.446671e-11 1.49786e-10 ] [ 8.4298e-13 2.294234e-10 2.779305e-10 ] [ 1.912564e-10 4.098673e-11 1.717336e-11 ] [ 2.851379e-10 2.549877e-11 2.412214e-10 ] [ 1.718971e-10 2.318251e-10 1.204915e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.8074559 -10.867419 5.0670623 ] [ -10.4449981 7.2787771 9.658102 ] [ 7.3159756 -8.3013345 -20.8090036 ] [ 13.2161964 -6.7181442 10.5418882 ] [ 5.7202821 18.6081206 -4.4580489 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.532633627730702e-08 -1.741152465023771e-08 8.118328753197076e-09 ] [ -1.673473176012042e-08 1.166188649763442e-08 1.547398522570172e-08 ] [ 1.172148506466325e-08 -1.330020405734046e-08 -3.333969907006304e-08 ] [ 2.117468088798113e-08 -1.076365357240312e-08 1.68899668131274e-08 ] [ 9.164902245000728e-09 2.981349578234687e-08 -7.142581721963157e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 91.307547 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.462908171059972e-17 } "relaxed-configuration-positions" { "source-value" [ [ -3.2320141 -3.6719265 1.7716137 ] [ -3.0343312 5.0834404 6.5990839 ] [ 3.8455005 -1.6789933 -5.0060704 ] [ 6.065439 -1.1180773 5.1224609 ] [ 3.7631441 7.2075639 -0.4210604 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.2320141e-10 -3.6719265e-10 1.7716137e-10 ] [ -3.0343312e-10 5.0834404e-10 6.5990839e-10 ] [ 3.8455005e-10 -1.6789933e-10 -5.006070399999999e-10 ] [ 6.065439e-10 -1.1180773e-10 5.1224609e-10 ] [ 3.7631441e-10 7.2075639e-10 -4.210604e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 0.0 ] [ -0.0 0.0 0.0 ] [ 0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" -1.7763568e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.846037335159101e-34 } }