{ "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" [ [ -11.0893781 -4.5367555 2.9660893 ] [ -9.5140159 -0.220263 4.2503796 ] [ 11.4629352 2.6048158 -6.4167624 ] [ 2.2138219 -2.8841318 1.5630918 ] [ 6.9266369 5.0363346 -2.3627984 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.776714233103153e-08 -7.268683596385814e-09 4.752198931665038e-09 ] [ -1.524313384489947e-08 -3.529002290272704e-10 6.809858824645256e-09 ] [ 1.836564678318537e-08 4.173374976250448e-09 -1.02807866985085e-08 ] [ 3.546933690795036e-09 -4.620888541265822e-09 2.50434913812419e-09 ] [ 1.109769570195059e-08 8.069097550646119e-09 -3.785620356143646e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.5122275 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.524026851223083e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2621242 0.8121759 0.7134819 ] [ 0.7988661 1.8747716 2.7787815 ] [ 2.6315756 0.8988618 0.4667972 ] [ 2.5647204 0.2734393 2.7661548 ] [ 2.31882 3.0748449 1.3887323 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.621242e-11 8.121759e-11 7.134819e-11 ] [ 7.988661e-11 1.8747716e-10 2.7787815e-10 ] [ 2.6315756e-10 8.988618e-11 4.667972000000001e-11 ] [ 2.5647204e-10 2.734393e-11 2.7661548e-10 ] [ 2.31882e-10 3.0748449e-10 1.3887323e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.6e-06 -1.42e-05 -6e-06 ] [ -1.24e-05 1.71e-05 2.16e-05 ] [ 1.27e-05 1.16e-05 -1.06e-05 ] [ 3e-07 -1.31e-05 2.2e-06 ] [ 7e-06 -1.4e-06 -7.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.217654231808e-14 -2.275090801536e-14 -9.6130597248e-15 ] [ -1.986699009792e-14 2.739722021568e-14 3.460701500928e-14 ] [ 2.034764308416e-14 1.858524880128e-14 -1.698307218048e-14 ] [ 4.8065298624e-16 -2.098851373248e-14 3.52478856576e-15 ] [ 1.12152363456e-14 -2.24304726912e-15 -1.153567166976e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.103084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.259563146597855e-18 } }