{ "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" [ [ 2.060429 2.678734 2.453953 ] [ 2.544795 1.257014 4.108114 ] [ 3.849483 1.551428 2.063601 ] [ 4.178567 2.654376 4.014408 ] [ 4.257126 3.923601 2.295059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.060429e-10 2.678734e-10 2.453953e-10 ] [ 2.544795e-10 1.257014e-10 4.108114e-10 ] [ 3.849483e-10 1.551428e-10 2.063601e-10 ] [ 4.178567e-10 2.654376e-10 4.014408000000001e-10 ] [ 4.257126000000001e-10 3.923601e-10 2.295059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -33.4549157 7.3217158 -14.5367547 ] [ -11.9493668 -13.0706837 16.8950728 ] [ 12.372337 -20.7952426 -24.4997492 ] [ 23.5808945 6.9071489 29.1573639 ] [ 9.4510511 19.6370616 -7.0159328 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.360068378537486e-08 1.173068187890197e-08 -2.329044852264452e-08 ] [ -1.914499612032371e-08 -2.094154384201164e-08 2.7068890646874e-08 ] [ 1.982266908605881e-08 -3.331765151758421e-08 -3.925292538370351e-08 ] [ 3.778075786545131e-08 1.106647248396444e-08 4.671524676473791e-08 ] [ 1.514225311440613e-08 3.146204099672944e-08 -1.124076350526388e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 19.743464 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.163251643440645e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7471187 1.5003462 2.2728421 ] [ 2.2220728 1.9081887 4.5400451 ] [ 3.5260973 2.353804 0.9926185 ] [ 4.2945893 3.0137048 4.6610299 ] [ 5.1005217 3.2891094 2.4685994 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7471187e-10 1.5003462e-10 2.2728421e-10 ] [ 2.2220728e-10 1.9081887e-10 4.540045100000001e-10 ] [ 3.5260973e-10 2.353804e-10 9.926185e-11 ] [ 4.2945893e-10 3.0137048e-10 4.661029900000001e-10 ] [ 5.1005217e-10 3.2891094e-10 2.4685994e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.1e-06 2.3e-06 6e-07 ] [ -2e-07 -0.0 2.2e-06 ] [ 1.1e-06 3e-07 -2.3e-06 ] [ -1.3e-06 -7e-07 1.2e-06 ] [ -3.6e-06 -1.9e-06 -1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.568924145279999e-15 3.68500622784e-15 9.6130597248e-16 ] [ -3.2043532416e-16 0.0 3.52478856576e-15 ] [ 1.76239428288e-15 4.8065298624e-16 -3.68500622784e-15 ] [ -2.08282960704e-15 -1.12152363456e-15 1.92261194496e-15 ] [ -5.76783583488e-15 -3.04413557952e-15 -2.72370025536e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.83321 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.735671579021677e-18 } }