{ "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" [ [ 1.63984 2.632724 3.733643 ] [ 2.059322 3.100925 1.548727 ] [ 0.4497259 4.960249 3.35449 ] [ 2.730005 4.489518 3.533282 ] [ 4.056337 2.434117 2.913545 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.63984e-10 2.632724e-10 3.733643e-10 ] [ 2.059322e-10 3.100925e-10 1.548727e-10 ] [ 4.497259e-11 4.960249e-10 3.35449e-10 ] [ 2.730005e-10 4.489518e-10 3.533282e-10 ] [ 4.056337e-10 2.434117e-10 2.913545e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2254121 -4.1465828 2.918184 ] [ -0.4049942 0.9689498 -2.1129305 ] [ -0.386517 -1.1778213 -1.0165836 ] [ 3.9206347 4.6456694 0.503097 ] [ 0.0962886 -0.2902152 -0.2917669 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.167679859065431e-09 -6.643558018371403e-09 4.675446179992627e-09 ] [ -6.488722387995994e-10 1.552428716288836e-09 -3.385287848475254e-09 ] [ -6.192685009417536e-10 -1.887077750340263e-09 -1.628746477008699e-09 ] [ 6.281549255037222e-09 7.443182900645964e-09 8.060502513946176e-10 ] [ 1.542713437695629e-10 -4.649760084407962e-10 -4.674621059032915e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -13.712416 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.196971232988385e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5841036 2.5209032 3.9603546 ] [ 1.9881958 3.3745762 1.5343587 ] [ 0.5318631 4.6238234 3.1282219 ] [ 2.9888388 4.6750403 3.5554994 ] [ 3.8422287 2.42319 2.9052524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5841036e-10 2.5209032e-10 3.9603546e-10 ] [ 1.9881958e-10 3.3745762e-10 1.5343587e-10 ] [ 5.318631000000001e-11 4.6238234e-10 3.1282219e-10 ] [ 2.9888388e-10 4.675040300000001e-10 3.5554994e-10 ] [ 3.8422287e-10 2.42319e-10 2.9052524e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.5e-06 1.13e-05 -9.5e-06 ] [ 1.9e-06 1.2e-06 1.88e-05 ] [ -1.59e-05 2.8e-06 1.2e-06 ] [ 1.5e-06 -7.9e-06 -6.1e-06 ] [ 1.89e-05 -7.4e-06 -4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.04141480352e-14 1.810459581504e-14 -1.52206778976e-14 ] [ 3.04413557952e-15 1.92261194496e-15 3.012092047104e-14 ] [ -2.547460827072e-14 4.48609453824e-15 1.92261194496e-15 ] [ 2.4032649312e-15 -1.265719530432e-14 -9.77327738688e-15 ] [ 3.028113813312e-14 -1.185610699392e-14 -7.04957713152e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.840953 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.538000454779163e-18 } }