{ "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" [ [ 1.743709 2.680969 1.034902 ] [ 2.749822 1.528948 3.390438 ] [ 1.938557 3.742026 2.98984 ] [ 3.932402 1.721019 1.334077 ] [ 5.171354 1.721023 3.429234 ] [ 4.220666 3.803748 1.650722 ] [ 4.237092 3.532846 4.042988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.743709e-10 2.680969e-10 1.034902e-10 ] [ 2.749822e-10 1.528948e-10 3.390438e-10 ] [ 1.938557e-10 3.742026e-10 2.98984e-10 ] [ 3.932402e-10 1.721019e-10 1.334077e-10 ] [ 5.171354e-10 1.721023e-10 3.429234e-10 ] [ 4.220666e-10 3.803748e-10 1.650722e-10 ] [ 4.237092e-10 3.532846e-10 4.042988e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.6863168 -2.6711673 -7.7427125 ] [ -4.0743265 -6.7702339 3.3448277 ] [ -1.6224295 2.8975889 4.1640911 ] [ -0.9808197 -6.6121541 -4.2557595 ] [ 6.1811681 -8.870791 0.4508419 ] [ 4.5327652 10.5360474 -0.3891608 ] [ 0.6499594 11.49071 4.4278722 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.508307276481651e-09 -4.279681833564868e-09 -1.240519305127972e-08 ] [ -6.527790717587e-09 -1.084711056129469e-08 5.359004785695962e-09 ] [ -2.599418635212303e-09 4.642449230517762e-09 6.671609462267357e-09 ] [ -1.57144640550689e-09 -1.05938387994273e-08 -6.818478430823522e-09 ] [ 9.903323100646173e-09 -1.421257406529749e-08 7.223283578081645e-10 ] [ 7.262290490848337e-09 1.688060895899645e-08 -6.235043406287471e-10 ] [ 1.041349763728659e-09 1.841014707007014e-08 7.094233377178175e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.558902 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.691722606509587e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.338555 3.2173313 0.9720364 ] [ 3.1004463 0.9795737 3.1566623 ] [ 1.8846833 3.1026278 3.4394087 ] [ 3.4479551 1.8255066 0.867152 ] [ 5.0756509 1.8349267 4.4857073 ] [ 4.9884714 3.7351467 1.3098806 ] [ 4.15784 4.0354663 3.6413537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.338555e-10 3.2173313e-10 9.720364e-11 ] [ 3.1004463e-10 9.795737e-11 3.1566623e-10 ] [ 1.8846833e-10 3.1026278e-10 3.4394087e-10 ] [ 3.4479551e-10 1.8255066e-10 8.671520000000001e-11 ] [ 5.075650900000001e-10 1.8349267e-10 4.4857073e-10 ] [ 4.9884714e-10 3.7351467e-10 1.3098806e-10 ] [ 4.15784e-10 4.0354663e-10 3.6413537e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.34e-05 -6.81e-05 -1.01e-05 ] [ 1.54e-05 3.74e-05 4.29e-05 ] [ -3.89e-05 5.53e-05 1.78e-05 ] [ 6.5e-06 3.72e-05 -5.52e-05 ] [ 2.9e-06 -3.53e-05 -3.65e-05 ] [ -9.7e-06 -1.91e-05 -4.2e-06 ] [ 2e-07 -7.3e-06 4.53e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.749093323559999e-14 -1.091082287754e-13 -1.61819840034e-14 ] [ 2.46735201636e-14 5.99214061116e-14 6.873337759859999e-14 ] [ -6.232467106259999e-14 8.86003678602e-14 2.851874408519999e-14 ] [ 1.0414148121e-14 5.96009707848e-14 -8.844015019679999e-14 ] [ 4.6463122386e-15 -5.655683518019999e-14 -5.847944714099999e-14 ] [ -1.55411133498e-14 -3.06015737094e-14 -6.729141862799999e-15 ] [ 3.204353268e-16 -1.16958894282e-14 7.25786015202e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.813779 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.334735037903988e-18 } }