{ "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" [ [ -1.9639835 -0.6862914 2.711482 ] [ -6.2317715 1.7921661 3.8771893 ] [ 8.1310411 -15.2610716 7.4863208 ] [ 17.0425948 4.6421273 1.3150133 ] [ -16.977881 9.5130696 -15.3900053 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.146648447336957e-09 -1.099560036136101e-09 4.344273068120026e-09 ] [ -9.984398603467748e-09 2.871366626010315e-09 6.211942050875917e-09 ] [ 1.302736395318391e-08 -2.445093212587485e-08 1.199440816156875e-08 ] [ 2.730524694632765e-08 7.437507830837428e-09 2.106883565301057e-09 ] [ -2.720156400892453e-08 1.524161770516321e-08 -2.465750668564809e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.45398352 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.273617819724892e-20 } "relaxed-configuration-positions" { "source-value" [ [ 1.0037819 0.2108311 3.0703647 ] [ 0.5503153 2.2739691 2.0697718 ] [ 3.0905563 -0.0269475 2.0093463 ] [ 2.9198993 2.0039586 0.8649407 ] [ 0.8886702 2.5663105 -0.2931241 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0037819e-10 2.108311e-11 3.0703647e-10 ] [ 5.503152999999999e-11 2.2739691e-10 2.0697718e-10 ] [ 3.0905563e-10 -2.69475e-12 2.0093463e-10 ] [ 2.9198993e-10 2.0039586e-10 8.649407e-11 ] [ 8.886702e-11 2.5663105e-10 -2.931241e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.9e-06 -1.49e-05 7.5e-06 ] [ -9e-06 1.05e-05 1.09e-05 ] [ -4.6e-06 8.7e-06 -3.6e-06 ] [ -7.5e-06 1e-07 -1.15e-05 ] [ 1.91e-05 -4.4e-06 -3.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.04413557952e-15 -2.387243164992e-14 1.2016324656e-14 ] [ -1.44195895872e-14 1.68228545184e-14 1.746372516672e-14 ] [ -7.370012455680001e-15 1.393893660096e-14 -5.76783583488e-15 ] [ -1.2016324656e-14 1.6021766208e-16 -1.84250311392e-14 ] [ 3.060157345728e-14 -7.04957713152e-15 -5.44740051072e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.844323 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.378322726220372e-18 } }