{ "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" [ [ 0.1837152 1.359189 0.2246076 ] [ 1.439885 0.3143995 0.1278355 ] [ 1.736921 1.45075 1.267781 ] [ 2.492617 0.9019618 2.872525 ] [ 2.597932 2.758406 2.155931 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.837152e-11 1.359189e-10 2.246076e-11 ] [ 1.439885e-10 3.143995e-11 1.278355e-11 ] [ 1.736921e-10 1.45075e-10 1.267781e-10 ] [ 2.492617e-10 9.019618e-11 2.872525e-10 ] [ 2.597932e-10 2.758406e-10 2.155931e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -65.8078523 33.4804605 -12.7958817 ] [ 24.9701506 -87.055077 -61.3723213 ] [ 35.5616573 53.0187807 60.1178176 ] [ 4.4410049 -18.7089761 20.4078848 ] [ 0.8350395 19.2648119 -6.3574995 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.054358024201195e-07 5.364161106671788e-08 -2.050126250226256e-08 ] [ 4.00065915091751e-08 -1.394776090913438e-07 -9.832929835108587e-08 ] [ 5.697605592296166e-08 8.494545090086226e-08 9.631936185223878e-08 ] [ 7.115274223638242e-09 -2.997508410652597e-08 3.269703590653968e-08 ] [ 1.337880764344522e-09 3.086563123028963e-08 -1.018583706564769e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 39.094621 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.263648776523671e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.593169 1.851804 0.8879836 ] [ 2.556654 -0.009166 -0.4129289 ] [ 1.6902124 1.3569473 1.3297332 ] [ 1.8647914 0.2038783 3.4018843 ] [ 2.9325814 3.3812426 1.4420078 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.93169e-11 1.851804e-10 8.879836e-11 ] [ 2.556654e-10 -9.166000000000002e-13 -4.129289e-11 ] [ 1.6902124e-10 1.3569473e-10 1.3297332e-10 ] [ 1.8647914e-10 2.038783e-11 3.4018843e-10 ] [ 2.9325814e-10 3.3812426e-10 1.4420078e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.28e-05 6.1e-06 -1.3e-06 ] [ -2.8e-06 1.07e-05 -3.4e-06 ] [ 5.3e-06 -9.8e-06 2.1e-06 ] [ -1.6e-06 2.4e-06 8.4e-06 ] [ -1.37e-05 -9.3e-06 -5.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.050786074624e-14 9.77327738688e-15 -2.08282960704e-15 ] [ -4.48609453824e-15 1.714328984256e-14 -5.44740051072e-15 ] [ 8.491536090240001e-15 -1.570133088384e-14 3.36457090368e-15 ] [ -2.56348259328e-15 3.84522388992e-15 1.345828361472e-14 ] [ -2.194981970496e-14 -1.490024257344e-14 -9.292624400640001e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.047831 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.930275315954949e-18 } }