{ "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" [ [ 0.6660422 0.1321237 2.521111 ] [ 1.154832 2.450071 0.6217319 ] [ 0.2052378 1.707228 1.69737 ] [ 2.767871 1.123615 2.427941 ] [ 1.781428 1.004966 1.555643 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.660422e-11 1.321237e-11 2.521111e-10 ] [ 1.154832e-10 2.450071e-10 6.217319e-11 ] [ 2.052378e-11 1.707228e-10 1.69737e-10 ] [ 2.767871e-10 1.123615e-10 2.427941e-10 ] [ 1.781428e-10 1.004966e-10 1.555643e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -21.0506671 -33.9825305 24.9217447 ] [ 11.3514858 38.4960778 -43.1347578 ] [ -63.2279462 11.3981669 18.8765761 ] [ 87.1210938 4.9630681 67.5475342 ] [ -14.1939663 -20.8747823 -68.2110971 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.372688667986373e-08 -5.444601588272294e-08 3.992903670788631e-08 ] [ 1.818708516010319e-08 6.16775158436579e-08 -6.910950049103044e-08 ] [ -1.013023371828402e-07 1.826187652715641e-08 3.024360890817205e-08 ] [ 1.395833796648838e-07 7.951711677258277e-09 1.082230800879284e-07 ] [ -2.274124096228308e-08 -3.344508816534965e-08 -1.092862250527387e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 54.937558 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.801967103144402e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1543016 0.0627588 2.5263981 ] [ 1.0175408 2.6590451 0.5657671 ] [ -1.0206589 1.8602062 1.4999106 ] [ 4.2317254 0.9744021 2.6394742 ] [ 2.1925022 0.8615915 1.5922469 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.543016e-11 6.275880000000001e-12 2.526398100000001e-10 ] [ 1.0175408e-10 2.6590451e-10 5.657671e-11 ] [ -1.0206589e-10 1.8602062e-10 1.4999106e-10 ] [ 4.2317254e-10 9.744021000000001e-11 2.6394742e-10 ] [ 2.1925022e-10 8.615915e-11 1.5922469e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7e-07 -5.4e-06 0.0 ] [ 2.1e-06 1.3e-06 -4.9e-06 ] [ 5e-06 7e-07 3.4e-06 ] [ -5e-07 1e-06 7e-07 ] [ -5.8e-06 2.4e-06 8e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.12152363456e-15 -8.65175375232e-15 0.0 ] [ 3.36457090368e-15 2.08282960704e-15 -7.850665441919999e-15 ] [ 8.010883104e-15 1.12152363456e-15 5.44740051072e-15 ] [ -8.010883104e-16 1.6021766208e-15 1.12152363456e-15 ] [ -9.292624400640001e-15 3.84522388992e-15 1.28174129664e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.303887 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.811082347556505e-18 } }