{ "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" [ [ 1.931726 1.779285 1.793394 ] [ 2.022352 0.7174538 3.630998 ] [ 4.124201 0.9725878 2.711634 ] [ 3.467636 2.844975 3.645464 ] [ 5.471294 3.704408 2.165903 ] [ 3.262896 3.451778 1.529715 ] [ 3.831227 5.45457 3.339943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.931726e-10 1.779285e-10 1.793394e-10 ] [ 2.022352e-10 7.174538e-11 3.630998e-10 ] [ 4.124201e-10 9.725878e-11 2.711634e-10 ] [ 3.467636e-10 2.844975e-10 3.645464e-10 ] [ 5.471294000000001e-10 3.704408e-10 2.165903e-10 ] [ 3.262896e-10 3.451778e-10 1.529715e-10 ] [ 3.831227000000001e-10 5.454570000000001e-10 3.339943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.7981542 -0.1095028 -5.5145941 ] [ -4.657406 -4.4478806 4.8414907 ] [ 5.369466 1.8063295 -4.150575 ] [ 1.497056 5.5772035 5.551572 ] [ 1.5666214 1.2857222 0.9083062 ] [ 1.6329079 -0.9220825 0.1274637 ] [ 0.389509 -3.1897894 -1.7636635 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.289667103033328e-09 -1.754428260721382e-10 -8.835353740221619e-09 ] [ -7.461987006773645e-09 -7.126290309429877e-09 7.756923209360627e-09 ] [ 8.602832891380492e-09 2.894058894361353e-09 -6.64995422787696e-09 ] [ 2.398548123228365e-09 8.935665057143933e-09 8.894598867087897e-09 ] [ 2.510004180724965e-09 2.059954049683542e-09 1.455266958167689e-09 ] [ 2.616206861299624e-09 -1.477339023948816e-09 2.04219360140665e-10 ] [ 6.240622133911871e-10 -5.11060600195566e-09 -2.825700426658301e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.655879 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.989001317427368e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6729355 1.9154639 1.9285993 ] [ 2.4740903 0.4871593 3.8882107 ] [ 4.1511006 1.3050252 2.1438287 ] [ 3.0764819 3.0041381 3.7582944 ] [ 5.4295494 3.3172272 2.8266411 ] [ 3.4157195 3.5484635 1.2609523 ] [ 3.8914548 5.3475803 3.0105246 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6729355e-10 1.9154639e-10 1.9285993e-10 ] [ 2.4740903e-10 4.871593e-11 3.8882107e-10 ] [ 4.1511006e-10 1.3050252e-10 2.1438287e-10 ] [ 3.0764819e-10 3.0041381e-10 3.7582944e-10 ] [ 5.429549400000001e-10 3.3172272e-10 2.8266411e-10 ] [ 3.4157195e-10 3.5484635e-10 1.2609523e-10 ] [ 3.8914548e-10 5.3475803e-10 3.0105246e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.48e-05 1.28e-05 4.68e-05 ] [ -7.6e-06 5.62e-05 -8.02e-05 ] [ -0.0001082 -1.32e-05 8.57e-05 ] [ 7.14e-05 -6.9e-06 -5.2e-05 ] [ -4.5e-06 7.17e-05 -3.56e-05 ] [ 2.84e-05 -8.3e-06 1.88e-05 ] [ -5.43e-05 -0.0001123 1.64e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.1984281123584e-13 2.050786074624e-14 7.498186585344001e-14 ] [ -1.217654231808e-14 9.004232608896e-14 -1.2849456498816e-13 ] [ -1.7335551037056e-13 -2.114873139456e-14 1.3730653640256e-13 ] [ 1.1439541072512e-13 -1.105501868352e-14 -8.33131842816e-14 ] [ -7.2097947936e-15 1.1487606371136e-13 -5.703748770048e-14 ] [ 4.550181603071999e-14 -1.329806595264e-14 3.012092047104e-14 ] [ -8.699819050944e-14 -1.7992443451584e-13 2.627569658112e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.52229 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.928903972647764e-18 } }