{ "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" [ [ 0.4523459 0.4778673 0.765296 ] [ 0.8876723 1.989638 2.471047 ] [ 2.135329 1.164008 0.2412907 ] [ 2.495776 0.5844002 2.912252 ] [ 2.604983 2.71818 1.724062 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.523459e-11 4.778673e-11 7.65296e-11 ] [ 8.876723e-11 1.989638e-10 2.471047e-10 ] [ 2.135329e-10 1.164008e-10 2.412907e-11 ] [ 2.495776e-10 5.844002e-11 2.912252e-10 ] [ 2.604983e-10 2.71818e-10 1.724062e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.5392556 -3.8416965 3.8548287 ] [ -7.5943295 -0.1004512 1.7412951 ] [ 8.3947928 1.8239699 -2.1537853 ] [ 0.75329 -1.6768287 -2.562873 ] [ 5.9855022 3.7950064 -0.8794655 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.207921906055548e-08 -6.155076316509187e-09 6.176116420328857e-09 ] [ -1.216745717555175e-08 -1.60940564171305e-10 2.789862299133598e-09 ] [ 1.344994076062017e-08 2.922321930822914e-09 -3.450744453882714e-09 ] [ 1.206903626682432e-09 -2.686575740226457e-09 -4.106175202679559e-09 ] [ 9.589831688586967e-09 6.080270529866373e-09 -1.409059062900183e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.867535 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.061606374432573e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.408002 -0.0131539 1.2039143 ] [ 0.6719869 2.2207325 2.0913764 ] [ 2.1013677 1.4334397 0.2618924 ] [ 2.3723091 0.5062839 2.5150998 ] [ 3.0224405 2.7867913 2.0416647 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.08002e-11 -1.31539e-12 1.2039143e-10 ] [ 6.719869e-11 2.2207325e-10 2.0913764e-10 ] [ 2.1013677e-10 1.4334397e-10 2.618924e-11 ] [ 2.3723091e-10 5.062839e-11 2.5150998e-10 ] [ 3.0224405e-10 2.7867913e-10 2.0416647e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-07 -0.0 2e-07 ] [ 1e-07 -1e-07 -1e-07 ] [ -1e-07 1e-07 -3e-07 ] [ -2e-07 -1e-07 1e-07 ] [ 0.0 1e-07 2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6021766208e-16 0.0 3.2043532416e-16 ] [ 1.6021766208e-16 -1.6021766208e-16 -1.6021766208e-16 ] [ -1.6021766208e-16 1.6021766208e-16 -4.8065298624e-16 ] [ -3.2043532416e-16 -1.6021766208e-16 1.6021766208e-16 ] [ 0.0 1.6021766208e-16 3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }