{ "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" [ [ 1.175063 2.090387 1.108777 ] [ 2.290473 2.943113 3.7458 ] [ 1.562387 4.346014 1.227002 ] [ 3.205072 1.346551 2.036178 ] [ 4.414518 1.768723 4.119804 ] [ 3.44377 3.554925 2.238453 ] [ 4.008705 3.851776 5.027783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.175063e-10 2.090387e-10 1.108777e-10 ] [ 2.290473e-10 2.943113e-10 3.7458e-10 ] [ 1.562387e-10 4.346014000000001e-10 1.227002e-10 ] [ 3.205072e-10 1.346551e-10 2.036178e-10 ] [ 4.414518e-10 1.768723e-10 4.119804e-10 ] [ 3.44377e-10 3.554925e-10 2.238453e-10 ] [ 4.008705e-10 3.851776e-10 5.027783000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3244771 -1.3035985 -1.2289842 ] [ -6.3282735 -2.7982724 7.3740537 ] [ -0.6775079 0.0893635 -0.5704357 ] [ -0.3974183 -3.1297524 -0.873281 ] [ 1.603728 -2.7550736 1.5498514 ] [ 7.5953846 8.4443843 -8.5068029 ] [ 0.5285643 1.4529491 2.2555987 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.724222865204984e-09 -2.088595039609949e-09 -1.969049752572592e-09 ] [ -1.013901185172819e-08 -4.483326617909906e-09 1.181453643866374e-08 ] [ -1.085487317787304e-09 1.431761104528608e-10 -9.139387422096826e-10 ] [ -6.367343089380806e-10 -5.01441612417269e-09 -1.399150401588845e-09 ] [ 2.569455507722342e-09 -4.41411451050329e-09 2.48313567879415e-09 ] [ 1.216914763210436e-08 1.352939510251057e-08 -1.362940072413364e-08 ] [ 8.468533640495174e-10 2.327881079232401e-09 3.613867503046873e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.896331 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.707090650549829e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3830806 1.6512176 1.0674054 ] [ 2.6594409 3.4974703 4.040623 ] [ 1.1737743 3.9036193 0.7155014 ] [ 3.4614652 1.9915329 2.0669537 ] [ 3.6778616 1.2742172 4.3541627 ] [ 3.1319714 4.3775075 1.8590694 ] [ 4.6123939 3.2059242 5.4000814 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3830806e-10 1.6512176e-10 1.0674054e-10 ] [ 2.6594409e-10 3.4974703e-10 4.040623e-10 ] [ 1.1737743e-10 3.9036193e-10 7.155014e-11 ] [ 3.4614652e-10 1.9915329e-10 2.0669537e-10 ] [ 3.6778616e-10 1.2742172e-10 4.3541627e-10 ] [ 3.1319714e-10 4.3775075e-10 1.8590694e-10 ] [ 4.6123939e-10 3.2059242e-10 5.400081400000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.47e-05 2.16e-05 1.03e-05 ] [ 2.29e-05 -1.14e-05 -1.4e-05 ] [ -2e-07 -1.15e-05 -3.6e-06 ] [ -1.34e-05 -1.7e-05 -1.7e-05 ] [ -1.88e-05 8e-06 -2.24e-05 ] [ -1.89e-05 -6.9e-06 6.1e-06 ] [ 1.38e-05 1.71e-05 4.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.355199632576e-14 3.460701500928e-14 1.650241919424e-14 ] [ 3.668984461632e-14 -1.826481347712e-14 -2.24304726912e-14 ] [ -3.2043532416e-16 -1.84250311392e-14 -5.76783583488e-15 ] [ -2.146916671872e-14 -2.72370025536e-14 -2.72370025536e-14 ] [ -3.012092047104e-14 1.28174129664e-14 -3.588875630592e-14 ] [ -3.028113813312e-14 -1.105501868352e-14 9.77327738688e-15 ] [ 2.211003736704e-14 2.739722021568e-14 6.488815314240001e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.530159 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.289294077110671e-18 } }