{ "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" [ [ 2.975716 3.919 3.294603 ] [ 5.229011 2.380728 1.260294 ] [ 3.72512 0.5184044 0.8589665 ] [ 3.15133 1.64182 3.064405 ] [ 5.039876 3.004083 3.766304 ] [ 5.090657 4.730463 1.850516 ] [ 3.207695 3.468122 0.7711985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.975716e-10 3.919e-10 3.294603e-10 ] [ 5.229011e-10 2.380728e-10 1.260294e-10 ] [ 3.72512e-10 5.184044e-11 8.589665e-11 ] [ 3.151330000000001e-10 1.64182e-10 3.064405e-10 ] [ 5.039876e-10 3.004083e-10 3.766304e-10 ] [ 5.090657000000001e-10 4.730463000000001e-10 1.850516e-10 ] [ 3.207695e-10 3.468122e-10 7.711985e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2030889 2.7780001 -1.4367865 ] [ 1.2549585 -1.5126167 0.3879768 ] [ -0.2380402 1.2068759 0.8789062 ] [ -0.0386598 -2.9776606 -0.632189 ] [ 2.1114054 -0.283608 -0.2927452 ] [ -0.9014025 0.0941362 0.9282092 ] [ -0.9851726 0.6948731 0.1666285 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.927560924204762e-09 4.450846849469663e-09 -2.30198575834664e-09 ] [ 2.010665185339689e-09 -2.423479132938188e-09 6.216073634940912e-10 ] [ -3.813824463926868e-10 1.933628367117721e-09 1.408162977117731e-09 ] [ -6.19398282351132e-11 -4.770738237302421e-09 -1.012878444071826e-09 ] [ 3.382844396781424e-09 -4.54390110815472e-10 -4.690295191556567e-10 ] [ -1.444206023329185e-09 1.508228200535508e-10 1.487155091703833e-09 ] [ -1.578420520177028e-09 1.113309444415145e-09 2.66968289258469e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.314646 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.254765114918156e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8613471 3.8320092 3.0234376 ] [ 5.5511098 2.408937 1.1703522 ] [ 3.5338164 1.0609551 1.1188617 ] [ 3.1262297 1.4487859 3.3966409 ] [ 5.1166056 2.8223682 3.5987914 ] [ 4.9344748 4.6710441 1.9631973 ] [ 3.2958217 3.4185209 0.5950058 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8613471e-10 3.8320092e-10 3.0234376e-10 ] [ 5.5511098e-10 2.408937e-10 1.1703522e-10 ] [ 3.5338164e-10 1.0609551e-10 1.1188617e-10 ] [ 3.1262297e-10 1.4487859e-10 3.3966409e-10 ] [ 5.1166056e-10 2.8223682e-10 3.5987914e-10 ] [ 4.9344748e-10 4.6710441e-10 1.9631973e-10 ] [ 3.2958217e-10 3.4185209e-10 5.950058e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.47e-05 -2.63e-05 2.63e-05 ] [ -1e-06 1.32e-05 2.7e-06 ] [ -3.67e-05 -5.4e-06 -8.1e-06 ] [ 2.29e-05 0.0 1.08e-05 ] [ -3.4e-06 -5e-07 2.89e-05 ] [ 2.98e-05 1.98e-05 -1.75e-05 ] [ 1.3e-05 -1e-06 -4.32e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.95737628598e-14 -4.21372454742e-14 4.21372454742e-14 ] [ -1.602176634e-15 2.11487315688e-14 4.3258769118e-15 ] [ -5.879988246779999e-14 -8.6517538236e-15 -1.29776307354e-14 ] [ 3.66898449186e-14 0.0 1.73035076472e-14 ] [ -5.4474005556e-15 -8.010883169999999e-16 4.63029047226e-14 ] [ 4.77448636932e-14 3.17230973532e-14 -2.8038091095e-14 ] [ 2.082829624199999e-14 -1.602176634e-15 -6.92140305888e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.563325 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.615043210034805e-18 } }