{ "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" [ [ 1.558502 1.467528 2.474942 ] [ 1.379624 2.873279 4.407553 ] [ 1.24144 3.597751 1.918679 ] [ 3.591005 1.301821 3.64335 ] [ 3.465479 3.687448 2.931727 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.558502e-10 1.467528e-10 2.474942e-10 ] [ 1.379624e-10 2.873279e-10 4.407553e-10 ] [ 1.24144e-10 3.597751e-10 1.918679e-10 ] [ 3.591005e-10 1.301821e-10 3.64335e-10 ] [ 3.465479e-10 3.687448e-10 2.931727e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.7876413 3.5289374 4.8791444 ] [ 4.4287912 -1.621834 -8.704511 ] [ 3.9899096 -1.3024733 5.1995351 ] [ -5.2888934 5.5394053 -2.2915048 ] [ -6.9174488 -6.1440355 0.9173363 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.068470338836519e-09 5.653980998546737e-09 7.817251087187244e-09 ] [ 7.095705719044777e-09 -2.598464517618547e-09 -1.394616401969643e-08 ] [ 6.392539880225479e-09 -2.086792270476224e-09 8.330573576248991e-09 ] [ -8.473741355383424e-09 8.875105664795612e-09 -3.671395417010979e-09 ] [ -1.108297474294101e-08 -9.843830035465239e-09 1.469734773271175e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.089159 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.218638088133391e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8602522 1.6181211 2.3256498 ] [ 1.6384252 2.8248624 4.179653 ] [ 1.1221345 3.7038477 2.212763 ] [ 3.372286 1.4672828 3.937735 ] [ 3.242952 3.313713 2.7204501 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8602522e-10 1.6181211e-10 2.3256498e-10 ] [ 1.6384252e-10 2.8248624e-10 4.179653e-10 ] [ 1.1221345e-10 3.7038477e-10 2.212763e-10 ] [ 3.372286e-10 1.4672828e-10 3.937735e-10 ] [ 3.242952e-10 3.313713e-10 2.7204501e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-05 -1.59e-05 -7.2e-06 ] [ -4.46e-05 1.64e-05 -6.26e-05 ] [ 8.14e-05 -9e-05 0.0001364 ] [ -6.48e-05 4.02e-05 -1.55e-05 ] [ 3.9e-05 4.94e-05 -5.11e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.76239428288e-14 -2.547460827072e-14 -1.153567166976e-14 ] [ -7.145707728768e-14 2.627569658112e-14 -1.0029625646208e-13 ] [ 1.3041717693312e-13 -1.44195895872e-13 2.1853689107712e-13 ] [ -1.0382104502784e-13 6.440750015616e-14 -2.48337376224e-14 ] [ 6.248488821120001e-14 7.914752506752001e-14 -8.187122532288001e-14 ] ] } "relaxed-potential-energy" { "source-value" -28.867458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.625076630952593e-18 } }