{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.173582 1.448006 2.849718 ] [ 1.983285 3.621531 1.348175 ] [ 2.327062 3.623818 3.682153 ] [ 3.341801 1.495458 1.660386 ] [ 3.963915 2.011825 3.715692 ] [ 4.47485 3.510245 1.32465 ] [ 4.551743 4.234559 4.054178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.173582e-10 1.448006e-10 2.849718e-10 ] [ 1.983285e-10 3.621531e-10 1.348175e-10 ] [ 2.327062e-10 3.623818e-10 3.682153e-10 ] [ 3.341801e-10 1.495458e-10 1.660386e-10 ] [ 3.963915e-10 2.011825e-10 3.715692e-10 ] [ 4.47485e-10 3.510245e-10 1.32465e-10 ] [ 4.551743e-10 4.234559e-10 4.054178000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.0723195 -10.746533 1.595662 ] [ -7.1637182 12.1468178 -8.7164729 ] [ -17.7399004 16.5038024 16.7533809 ] [ 7.4091083 -20.4394913 -12.7188058 ] [ 11.9466494 -14.7838618 15.0401812 ] [ 12.7928189 9.0889249 -15.1665196 ] [ 7.8273614 8.2303409 3.2125742 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.414851792412795e-08 -1.721784392725568e-08 2.55653235109897e-09 ] [ -1.147754181803946e-08 1.946134749627729e-08 -1.396532909621678e-08 ] [ -2.842245367620057e-08 2.644200635958293e-08 2.684187519733726e-08 ] [ 1.187070009923523e-08 -3.2747675101905e-08 -2.037777329725544e-08 ] [ 1.914064236557435e-08 -2.368635774109821e-08 2.409702669123569e-08 ] [ 2.049635535570837e-08 1.456206298298698e-08 -2.429944312202497e-08 ] [ 1.254081543763236e-08 1.318645977119403e-08 5.147111275825263e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 3.3440725 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.357794777760208e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.4383794 1.5824775 2.8986583 ] [ 2.5267731 4.7157897 1.3568742 ] [ 1.7920695 3.85769 3.4347332 ] [ 3.5954109 1.202574 2.0087335 ] [ 4.9684082 1.9355543 3.7895313 ] [ 3.7425512 2.9258067 0.3955248 ] [ 3.7526456 3.7255498 4.7508968 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4383794e-10 1.5824775e-10 2.8986583e-10 ] [ 2.5267731e-10 4.7157897e-10 1.3568742e-10 ] [ 1.7920695e-10 3.85769e-10 3.4347332e-10 ] [ 3.5954109e-10 1.202574e-10 2.0087335e-10 ] [ 4.9684082e-10 1.9355543e-10 3.7895313e-10 ] [ 3.7425512e-10 2.9258067e-10 3.955248000000001e-11 ] [ 3.752645600000001e-10 3.7255498e-10 4.7508968e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.3e-06 -2.12e-05 -2e-07 ] [ -1.38e-05 4.26e-05 3.74e-05 ] [ -2.92e-05 1.88e-05 -2.41e-05 ] [ 2.69e-05 2.76e-05 -1.7e-06 ] [ -3.94e-05 8.5e-06 2.15e-05 ] [ 1.3e-06 -5.55e-05 -3.5e-05 ] [ 4.61e-05 -2.07e-05 2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.329806595264e-14 -3.396614436096001e-14 -3.2043532416e-16 ] [ -2.211003736704e-14 6.825272404608e-14 5.992140561792e-14 ] [ -4.678355732736e-14 3.012092047104e-14 -3.861245656128e-14 ] [ 4.309855109952001e-14 4.422007473408001e-14 -2.72370025536e-15 ] [ -6.312575885952001e-14 1.36185012768e-14 3.44467973472e-14 ] [ 2.08282960704e-15 -8.892080245440001e-14 -5.6076181728e-14 ] [ 7.386034221888001e-14 -3.316505605055999e-14 3.36457090368e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.037353 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.889902527771674e-18 } }