{ "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" [ [ 1.724599 2.153048 2.374712 ] [ 0.8645185 3.613019 0.4039649 ] [ 2.279761 4.306527 2.243044 ] [ 4.11856 1.980977 2.568835 ] [ 3.209467 2.952847 0.6643367 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724599e-10 2.153048e-10 2.374712e-10 ] [ 8.645185e-11 3.613019e-10 4.039649e-11 ] [ 2.279761e-10 4.306527e-10 2.243044e-10 ] [ 4.118560000000001e-10 1.980977e-10 2.568835e-10 ] [ 3.209467e-10 2.952847e-10 6.643367000000001e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.9678837 6.0576103 -4.2674756 ] [ 2.5470115 -0.3535718 0.5678915 ] [ -0.466143 -6.1663238 -4.7426918 ] [ -0.4159233 -0.9742137 -1.5379595 ] [ -7.6328289 1.436499 9.9802353 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.561603818569463e-09 9.70536168053773e-09 -6.837249692485129e-09 ] [ 4.080762311829291e-09 -5.664844764013211e-10 9.098624919472109e-10 ] [ -7.468434227026619e-10 -9.879539910038089e-09 -7.598629984223401e-09 ] [ -6.663825927961722e-10 -1.560862426662685e-09 -2.464082774938322e-09 ] [ -1.222914011489992e-08 2.301525132564366e-09 1.599009979948198e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 5.438513374023451 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.713459051556875e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.784396 2.2137441 2.3319527 ] [ 0.8900391 3.6094763 0.4096551 ] [ 2.2750903 4.2447416 2.1955232 ] [ 4.1143925 1.9712156 2.5534249 ] [ 3.1329876 2.9672404 0.7643367 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.784396e-10 2.2137441e-10 2.3319527e-10 ] [ 8.900391e-11 3.6094763e-10 4.096551e-11 ] [ 2.2750903e-10 4.244741600000001e-10 2.1955232e-10 ] [ 4.1143925e-10 1.9712156e-10 2.5534249e-10 ] [ 3.1329876e-10 2.9672404e-10 7.643367e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 64.2864924 2.4338968 -28.8741784 ] [ 80.9708523 0.399506 62.204783 ] [ -80.3685471 51.5170846 -45.0133582 ] [ -20.3686259 -31.0226121 -17.7706113 ] [ -44.5201716 -23.3278752 29.4533649 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.029983160050986e-07 3.899532582527371e-09 -4.626153395842751e-08 ] [ 1.297296075901251e-07 6.400791783428039e-10 9.96630498456404e-08 ] [ -1.287646082721484e-07 8.253946919792123e-08 -7.211935072591229e-08 ] [ -3.263413648366722e-08 -4.970370423226566e-08 -2.847165819675636e-08 ] [ -7.132917867919039e-08 -3.737537656630807e-08 4.718949303545574e-08 ] ] } "relaxed-potential-energy" { "source-value" 1.6032113740234522 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.568627802823409e-19 } }