{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.915912 1.360436 2.810198 ] [ 1.265862 2.897087 3.881297 ] [ 2.470833 3.120785 1.738737 ] [ 4.740838 1.736953 1.131717 ] [ 4.024671 3.068015 3.686077 ] [ 4.392743 4.331921 1.580851 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.915912e-10 1.360436e-10 2.810198e-10 ] [ 1.265862e-10 2.897087e-10 3.881297e-10 ] [ 2.470833e-10 3.120785e-10 1.738737e-10 ] [ 4.740838000000001e-10 1.736953e-10 1.131717e-10 ] [ 4.024671e-10 3.068015e-10 3.686077e-10 ] [ 4.392743000000001e-10 4.331921e-10 1.580851e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4893843 -5.6519652 0.5878107 ] [ -1.2738776 0.5378547 1.0526583 ] [ -4.2336723 3.1721793 -4.8973141 ] [ 0.5185317 0.1524417 -0.254025 ] [ 3.3358487 1.8535119 3.7264819 ] [ 1.1637851 -0.0640224 -0.2156118 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.840800840465734e-10 -9.055446505015197e-09 9.417765609960826e-10 ] [ -2.040976908480814e-09 8.617382257273977e-10 1.686544517951073e-09 ] [ -6.783090779188565e-09 5.082391511445709e-09 -7.846362155734193e-09 ] [ 8.307793668836794e-10 2.442385277750074e-10 -4.0699291609872e-10 ] [ 5.344618797666073e-09 2.969653432554587e-09 5.970482178014363e-09 ] [ 1.86458927885539e-09 -1.025751924875059e-10 -3.454481851286055e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.5050776 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.362663648880978e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.4837479 1.0815033 3.155441 ] [ 1.714399 2.7559508 3.3509576 ] [ 2.1925063 3.5064981 1.2491016 ] [ 3.9618712 1.832063 1.0535999 ] [ 3.9901147 3.294311 4.060811 ] [ 4.4682199 4.0448708 1.9589658 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.4837479e-10 1.0815033e-10 3.155441e-10 ] [ 1.714399e-10 2.7559508e-10 3.3509576e-10 ] [ 2.1925063e-10 3.5064981e-10 1.2491016e-10 ] [ 3.9618712e-10 1.832063e-10 1.0535999e-10 ] [ 3.9901147e-10 3.294311e-10 4.060811e-10 ] [ 4.4682199e-10 4.0448708e-10 1.9589658e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.7e-06 -1.08e-05 2.76e-05 ] [ 8.9e-06 7.7e-06 -3.23e-05 ] [ -2.1e-06 3.8e-06 1.93e-05 ] [ -5.5e-06 3.3e-06 -1.87e-05 ] [ -5.6e-06 -8.9e-06 2.33e-05 ] [ -3.3e-06 4.9e-06 -1.92e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.233675998016e-14 -1.730350750464e-14 4.422007473408001e-14 ] [ 1.425937192512e-14 1.233675998016e-14 -5.175030485184e-14 ] [ -3.36457090368e-15 6.08827115904e-15 3.092200878144e-14 ] [ -8.8119714144e-15 5.28718284864e-15 -2.996070280896e-14 ] [ -8.972189076479999e-15 -1.425937192512e-14 3.733071526464e-14 ] [ -5.28718284864e-15 7.850665441919999e-15 -3.076179111936e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.567729 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853354495955016e-18 } }