{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.498135 2.481711 1.187983 ] [ 2.675773 3.880836 2.786174 ] [ 3.481377 1.983179 1.905231 ] [ 5.086442 3.961768 1.927974 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.498135e-10 2.481711e-10 1.187983e-10 ] [ 2.675773e-10 3.880836e-10 2.786174e-10 ] [ 3.481377e-10 1.983179e-10 1.905231e-10 ] [ 5.086442e-10 3.961768e-10 1.927974e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.9176472 -1.2819184 -4.4416969 ] [ -1.0399562 6.2019253 5.2991497 ] [ 4.9974785 -5.7976078 -0.130326 ] [ 1.9601249 0.8776009 -0.7271269 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.481116072095525e-09 -2.053859707174665e-09 -7.116382988490234e-09 ] [ -1.66619352402343e-09 9.936579801473439e-09 8.49017382940811e-09 ] [ 8.006843281617368e-09 -9.288791750256143e-09 -2.08805272002684e-10 ] [ 3.140466314501586e-09 1.40607165595737e-09 -1.164985729132854e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.2347803 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.387042680783509e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7571744 2.3526289 0.4327646 ] [ 2.3887039 3.9352474 3.8227906 ] [ 3.3873809 2.3495345 2.2537757 ] [ 5.2084679 3.6700832 1.2980311 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7571744e-10 2.3526289e-10 4.327646e-11 ] [ 2.3887039e-10 3.9352474e-10 3.8227906e-10 ] [ 3.3873809e-10 2.3495345e-10 2.2537757e-10 ] [ 5.2084679e-10 3.6700832e-10 1.2980311e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.56e-05 -1.7e-06 1.6e-05 ] [ -5.3e-06 9.3e-06 1.14e-05 ] [ -1.1e-05 -7.1e-06 -2.74e-05 ] [ 7e-07 -5e-07 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.49939554904e-14 -2.7237002778e-15 2.5634826144e-14 ] [ -8.4915361602e-15 1.49002426962e-14 1.82648136276e-14 ] [ -1.7623942974e-14 -1.13754541014e-14 -4.389963977159999e-14 ] [ 1.1215236438e-15 -8.010883169999999e-16 0.0 ] ] } "relaxed-potential-energy" { "source-value" -9.1471636 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.465537178729532e-18 } }