{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.430797 0.9143471 3.003228 ] [ 2.900858 2.600657 5.132587 ] [ 1.698571 3.470708 2.452381 ] [ 4.30988 2.177249 1.737833 ] [ 5.127339 2.024866 3.874492 ] [ 3.797222 3.704908 3.463102 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.430797e-10 9.143471e-11 3.003228e-10 ] [ 2.900858e-10 2.600657e-10 5.132587e-10 ] [ 1.698571e-10 3.470708e-10 2.452381e-10 ] [ 4.30988e-10 2.177249e-10 1.737833e-10 ] [ 5.127339e-10 2.024866e-10 3.874492e-10 ] [ 3.797222e-10 3.704908e-10 3.463102e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.7137067 6.6257076 1.5191181 ] [ -1.0312851 -2.5017678 -2.2852421 ] [ 2.9689927 -4.1714577 1.4706817 ] [ -3.4321784 -0.0020071 -0.3398097 ] [ -1.267213 -3.3756903 1.6974017 ] [ -0.9520229 3.4252153 -2.0621496 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.95001405124832e-09 1.061555381297688e-08 2.433895504054116e-09 ] [ -1.65230087659939e-09 -4.00827387983025e-09 -3.661361465487896e-09 ] [ 4.756850691265868e-09 -6.683412001596141e-09 2.3562918363784e-09 ] [ -5.498955990894752e-09 -3.21572869560768e-12 -5.444351568610617e-10 ] [ -2.03029904217383e-09 -5.408452077721339e-09 2.719537319846175e-09 ] [ -1.525308832846216e-09 5.487799874866459e-09 -3.303927877712072e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.41717 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.110973581609914e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7608769 1.0179052 3.1507685 ] [ 2.716423 2.6191923 4.912525 ] [ 1.8859912 3.1672088 2.6169531 ] [ 4.0384651 2.345051 1.6420157 ] [ 4.8688984 1.7970379 3.9375885 ] [ 3.9940125 3.9463398 3.4037722 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7608769e-10 1.0179052e-10 3.1507685e-10 ] [ 2.716423e-10 2.6191923e-10 4.912525e-10 ] [ 1.8859912e-10 3.1672088e-10 2.6169531e-10 ] [ 4.0384651e-10 2.345051e-10 1.6420157e-10 ] [ 4.8688984e-10 1.7970379e-10 3.9375885e-10 ] [ 3.9940125e-10 3.9463398e-10 3.4037722e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.7e-06 0.0 -1.7e-06 ] [ 3.8e-06 1.04e-05 1.2e-06 ] [ -3e-06 -9.4e-06 -1.2e-06 ] [ 4.5e-06 5.6e-06 1.4e-06 ] [ -1.7e-06 -5.9e-06 -3.7e-06 ] [ -9e-07 -8e-07 4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.32587687616e-15 0.0 -2.72370025536e-15 ] [ 6.08827115904e-15 1.666263685632e-14 1.92261194496e-15 ] [ -4.8065298624e-15 -1.506046023552e-14 -1.92261194496e-15 ] [ 7.2097947936e-15 8.972189076479999e-15 2.24304726912e-15 ] [ -2.72370025536e-15 -9.45284206272e-15 -5.928053496960001e-15 ] [ -1.44195895872e-15 -1.28174129664e-15 6.4087064832e-15 ] ] } "relaxed-potential-energy" { "source-value" -24.062777 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.855281874092396e-18 } }