{ "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" [ [ 2.007741 0.810981 1.851579 ] [ 2.28758 2.972606 1.775704 ] [ 2.775609 2.277586 3.884458 ] [ 3.461309 1.568578 0.4572952 ] [ 4.556331 2.173826 2.191246 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.007741e-10 8.10981e-11 1.851579e-10 ] [ 2.28758e-10 2.972606e-10 1.775704e-10 ] [ 2.775609000000001e-10 2.277586e-10 3.884458e-10 ] [ 3.461309e-10 1.568578e-10 4.572952e-11 ] [ 4.556331e-10 2.173826e-10 2.191246e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.572328 -11.9292091 -0.0178953 ] [ -8.1161742 11.8719964 -1.2621231 ] [ -0.1675399 0.76019 7.7935034 ] [ 3.9317756 -3.117701 -9.8915897 ] [ 14.9242665 2.4147237 3.3781046 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.693873674902922e-08 -1.911269992465461e-08 -2.867143128220224e-11 ] [ -1.300354455358014e-08 1.902103507430177e-08 -2.02214412339162e-09 ] [ -2.684285108311699e-10 1.217958645365952e-09 1.248656894160531e-08 ] [ 6.299398944551892e-09 -4.995107652844781e-09 -1.584807375988609e-08 ] [ 2.391131086888864e-08 3.868813857831673e-09 5.412320212736936e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 3.4072957 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.459089510692372e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.0597335 0.2757258 2.0748999 ] [ 2.0713871 3.6038231 1.6278103 ] [ 2.7048855 2.1798387 3.6550452 ] [ 3.3305433 1.7415943 0.4090724 ] [ 4.9220206 2.0025952 2.3934544 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0597335e-10 2.757258e-11 2.0748999e-10 ] [ 2.0713871e-10 3.6038231e-10 1.6278103e-10 ] [ 2.7048855e-10 2.1798387e-10 3.6550452e-10 ] [ 3.3305433e-10 1.7415943e-10 4.090724e-11 ] [ 4.9220206e-10 2.0025952e-10 2.3934544e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-06 1.2e-06 3.9e-06 ] [ -4.7e-06 1.9e-06 1.16e-05 ] [ -4.3e-06 3e-07 -1.48e-05 ] [ -2.3e-06 -6.6e-06 -9.8e-06 ] [ 1.62e-05 3.2e-06 9.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883104e-15 1.92261194496e-15 6.24848882112e-15 ] [ -7.53023011776e-15 3.04413557952e-15 1.858524880128e-14 ] [ -6.889359469440001e-15 4.8065298624e-16 -2.371221398784e-14 ] [ -3.68500622784e-15 -1.057436569728e-14 -1.570133088384e-14 ] [ 2.595526125696e-14 5.126965186560001e-15 1.457980724928e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.4498528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.033380336376142e-18 } }