{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.716359 1.412699 2.394819 ] [ 3.01973 2.981726 2.588794 ] [ 1.169208 3.673412 1.754347 ] [ 3.934247 1.183557 2.830214 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.716359e-10 1.412699e-10 2.394819e-10 ] [ 3.01973e-10 2.981726e-10 2.588794e-10 ] [ 1.169208e-10 3.673412e-10 1.754347e-10 ] [ 3.934247e-10 1.183557e-10 2.830214e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.7224624 -3.2770415 -0.5452048 ] [ 3.033449 6.1257794 0.9503257 ] [ -1.9813448 0.7224351 -0.9692288 ] [ 2.6703582 -3.5711731 0.5641079 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.964042229087058e-09 -5.250399276691364e-09 -8.735143841079399e-10 ] [ 4.860121068189139e-09 9.814580538858253e-09 1.522589618685395e-09 ] [ -3.174464316303652e-09 1.15746862726531e-09 -1.552875723566039e-09 ] [ 4.278385477201571e-09 -5.721650049649861e-09 9.038004889885843e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.272749 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.645875827914658e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5325019 1.4149773 2.7222704 ] [ 3.0940361 3.2981678 3.0262835 ] [ 1.3389889 3.3988919 1.4219999 ] [ 3.874017 1.139357 2.3976202 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5325019e-10 1.4149773e-10 2.7222704e-10 ] [ 3.0940361e-10 3.2981678e-10 3.0262835e-10 ] [ 1.3389889e-10 3.3988919e-10 1.4219999e-10 ] [ 3.874017e-10 1.139357e-10 2.3976202e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-07 1.49e-05 -1.1e-05 ] [ -9.1e-06 5.4e-06 -6.3e-06 ] [ -9e-07 -6.9e-06 1.4e-05 ] [ 9.7e-06 -1.34e-05 3.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.8065298624e-16 2.387243164992e-14 -1.76239428288e-14 ] [ -1.457980724928e-14 8.65175375232e-15 -1.009371271104e-14 ] [ -1.44195895872e-15 -1.105501868352e-14 2.24304726912e-14 ] [ 1.554111322176e-14 -2.146916671872e-14 5.28718284864e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.031003 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.927579173137467e-18 } }