{ "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" [ [ 2.279778 0.7751999 2.437046 ] [ 2.78251 2.893695 2.394675 ] [ 4.420807 1.465039 1.355448 ] [ 4.595919 1.28038 3.495826 ] [ 3.524345 3.582501 0.1223867 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.279778e-10 7.751999000000001e-11 2.437046e-10 ] [ 2.78251e-10 2.893695e-10 2.394675e-10 ] [ 4.420807e-10 1.465039e-10 1.355448e-10 ] [ 4.595919e-10 1.28038e-10 3.495826e-10 ] [ 3.524345e-10 3.582501e-10 1.223867e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3547167 -1.5971395 -0.0520243 ] [ 0.6497765 1.9890425 -0.1187489 ] [ -0.4556322 0.2369726 -2.6096732 ] [ -0.5815555 0.1265294 1.8295483 ] [ 0.0326945 -0.7554049 0.950898 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.683188037473274e-10 -2.558899567056202e-09 -8.335211717348546e-11 ] [ 1.041056717045251e-09 3.186797391277584e-09 -1.902567113257171e-10 ] [ -7.300032585236698e-10 3.796719594901901e-10 -4.181157388968322e-09 ] [ -9.317546257976544e-10 2.027224465238515e-10 2.931259512884385e-09 ] [ 5.23823635287456e-11 -1.210292070017762e-09 1.523506544365478e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.4957987754089 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.20306368978141e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.4277175 1.0419821 1.9426508 ] [ 2.4927749 3.1538992 2.9439337 ] [ 4.5485628 0.8448258 0.9782139 ] [ 4.501951 1.9612373 3.0321025 ] [ 3.6323528 2.9948705 0.9084808 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4277175e-10 1.0419821e-10 1.9426508e-10 ] [ 2.4927749e-10 3.1538992e-10 2.9439337e-10 ] [ 4.5485628e-10 8.448258e-11 9.782139e-11 ] [ 4.501951e-10 1.9612373e-10 3.0321025e-10 ] [ 3.6323528e-10 2.9948705e-10 9.084808e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-06 3.7e-06 -6e-06 ] [ 3.9e-06 1e-07 2.1e-06 ] [ 3.4e-06 1.4e-06 4.3e-06 ] [ 2.5e-06 -2.2e-06 3.2e-06 ] [ -7.8e-06 -3e-06 -3.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-15 5.928053496960001e-15 -9.6130597248e-15 ] [ 6.24848882112e-15 1.6021766208e-16 3.36457090368e-15 ] [ 5.44740051072e-15 2.24304726912e-15 6.889359469440001e-15 ] [ 4.005441552e-15 -3.52478856576e-15 5.126965186560001e-15 ] [ -1.249697764224e-14 -4.8065298624e-15 -5.928053496960001e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.7659997754089005 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.238150035698192e-19 } }