{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.9727914e-10 2.056023e-10 1.2121832e-10 ] [ 2.0619589e-10 1.7198515e-10 3.7519811e-10 ] [ 2.2454341e-10 4.0172182e-10 2.6287623e-10 ] [ 3.394143e-10 2.871075e-11 2.0956671e-10 ] [ 4.3339579e-10 2.6696605e-10 1.9997239e-10 ] [ 4.5438106e-10 1.1554923e-10 4.0584757e-10 ] [ 3.8339889e-10 3.4604633e-10 4.3870787e-10 ] ] "source-value" [ [ 1.9727914 2.056023 1.2121832 ] [ 2.0619589 1.7198515 3.7519811 ] [ 2.2454341 4.0172182 2.6287623 ] [ 3.394143 0.2871075 2.0956671 ] [ 4.3339579 2.6696605 1.9997239 ] [ 4.5438106 1.1554923 4.0584757 ] [ 3.8339889 3.4604633 4.3870787 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -5.671705237632e-13 -4.20795667686912e-12 -3.74861263968576e-12 ] [ -1.441766697525504e-11 1.17663851031552e-12 1.40959499097984e-11 ] [ -1.96298679580416e-12 4.1752722738048e-13 -4.68380313324672e-12 ] [ -2.2694831833632e-12 -1.116604952334144e-11 -4.8898430466816e-12 ] [ 1.19914909183776e-11 1.374619475347776e-11 7.704867369427201e-12 ] [ 3.5712516877632e-12 -3.63662049389184e-12 -7.93814428541568e-12 ] [ 3.65440465438272e-12 3.67026620292864e-12 -5.4041417419584e-13 ] ] "source-value" [ [ -0.000354 -0.0026264 -0.0023397 ] [ -0.0089988 0.0007344 0.008798 ] [ -0.0012252 0.0002606 -0.0029234 ] [ -0.0014165 -0.0069693 -0.003052 ] [ 0.0074845 0.0085797 0.004809 ] [ 0.002229 -0.0022698 -0.0049546 ] [ 0.0022809 0.0022908 -0.0003373 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.254936020179542e-18 "source-value" -26.557222 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.307078077383889e-09 1.343402025197461e-09 -4.711203557815642e-09 ] [ 2.380456825479278e-09 -4.988394532803628e-10 4.874698952826473e-09 ] [ -3.798089936565671e-09 5.422614838396224e-09 -2.373869476302858e-09 ] [ 5.32313248765751e-10 2.326361574925235e-09 -1.064708368756825e-09 ] [ -3.870950039920186e-09 -5.313133143149435e-09 -4.406505293078125e-09 ] [ 1.851402564177896e-09 -2.063252771128106e-09 4.13904690019085e-09 ] [ -4.022107393209562e-10 -1.217152910743352e-09 3.542541003153788e-09 ] ] "source-value" [ [ 2.0641158 0.8384856 -2.940502 ] [ 1.4857643 -0.3113511 3.0425478 ] [ -2.3705813 3.38453 -1.4816528 ] [ 0.3322438 1.4520007 -0.6645387 ] [ -2.416057 -3.3161969 -2.7503243 ] [ 1.1555546 -1.2877811 2.5833899 ] [ -0.2510402 -0.7596871 2.2110802 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.86475426270989e-18 "source-value" -24.121899 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.899847e-10 1.906187e-10 1.523281e-10 ] [ 1.884769e-10 1.70171e-10 3.709853e-10 ] [ 2.49478e-10 3.91064e-10 2.644859e-10 ] [ 3.453021e-10 2.240813e-11 2.013003e-10 ] [ 4.505277e-10 2.817941e-10 2.046258e-10 ] [ 4.372743e-10 1.259433e-10 3.808578e-10 ] [ 3.775648e-10 3.545824e-10 4.38804e-10 ] ] "source-value" [ [ 1.899847 1.906187 1.523281 ] [ 1.884769 1.70171 3.709853 ] [ 2.49478 3.91064 2.644859 ] [ 3.453021 0.2240813 2.013003 ] [ 4.505277 2.817941 2.046258 ] [ 4.372743 1.259433 3.808578 ] [ 3.775648 3.545824 4.38804 ] ] } "instance-id" 1 }