{ "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" [ [ 1.442259 2.324158 2.548252 ] [ 2.158618 1.41899 4.605472 ] [ 2.34516 4.213318 2.000238 ] [ 2.029556 3.900131 4.500233 ] [ 3.591834 1.471441 2.657937 ] [ 4.338938 2.513725 4.512162 ] [ 5.128703 3.807673 2.402827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.442259e-10 2.324158e-10 2.548252e-10 ] [ 2.158618e-10 1.41899e-10 4.605472e-10 ] [ 2.34516e-10 4.213318e-10 2.000238e-10 ] [ 2.029556e-10 3.900131e-10 4.500233e-10 ] [ 3.591834e-10 1.471441e-10 2.657937e-10 ] [ 4.338938e-10 2.513725e-10 4.512162e-10 ] [ 5.128703e-10 3.807673e-10 2.402827e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.0463348 -1.5948214 -2.3887113 ] [ -1.934492 -1.6724113 3.8732729 ] [ 5.7081067 1.9119605 -0.1701898 ] [ 2.001391 -0.1095772 1.0720134 ] [ 5.3022664 2.2733164 -4.212521 ] [ 1.0825614 3.8417912 0.3051289 ] [ -8.1134987 -4.6502582 1.5210069 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.482943016489445e-09 -2.555185561431526e-09 -3.827137398700776e-09 ] [ -3.099397855524634e-09 -2.679498285221735e-09 6.205667286358216e-09 ] [ 9.14539510377184e-09 3.063298412993078e-09 -2.726741186586278e-10 ] [ 3.206581869279533e-09 -1.755620280127258e-10 1.717554806664319e-09 ] [ 8.495167263333381e-09 3.642254387761221e-09 -6.749202660829036e-09 ] [ 1.734454565660517e-09 6.155228042635177e-09 4.888703899104211e-10 ] [ -1.299925793003119e-08 -7.45053496872349e-09 2.436921695255484e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.574431 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.456604895526277e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4583331 2.3285973 2.4654975 ] [ 2.2264968 1.3268523 4.6469582 ] [ 2.5619799 4.5633731 2.1252141 ] [ 2.0214164 3.8327005 4.4708437 ] [ 3.7227 1.2758169 2.6193639 ] [ 4.2857627 2.7798885 4.624735 ] [ 4.7583792 3.5422074 2.2745084 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4583331e-10 2.3285973e-10 2.4654975e-10 ] [ 2.2264968e-10 1.3268523e-10 4.646958200000001e-10 ] [ 2.5619799e-10 4.5633731e-10 2.1252141e-10 ] [ 2.0214164e-10 3.8327005e-10 4.4708437e-10 ] [ 3.7227e-10 1.2758169e-10 2.6193639e-10 ] [ 4.285762700000001e-10 2.7798885e-10 4.624735e-10 ] [ 4.7583792e-10 3.5422074e-10 2.2745084e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.62e-05 1.03e-05 -2.96e-05 ] [ 4.97e-05 -2.45e-05 3.38e-05 ] [ 2.56e-05 7.6e-06 9.5e-06 ] [ -4.33e-05 2.95e-05 -2.5e-06 ] [ 9.8e-06 3.33e-05 1.39e-05 ] [ -1.04e-05 -2.65e-05 -2.36e-05 ] [ -1.53e-05 -2.97e-05 -1.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.595526125696e-14 1.650241919424e-14 -4.742442797568e-14 ] [ 7.962817805376001e-14 -3.92533272096e-14 5.415356978304e-14 ] [ 4.101572149248001e-14 1.217654231808e-14 1.52206778976e-14 ] [ -6.937424768064e-14 4.72642103136e-14 -4.005441552e-15 ] [ 1.570133088384e-14 5.335248147264001e-14 2.227025502912e-14 ] [ -1.666263685632e-14 -4.24576804512e-14 -3.781136825088e-14 ] [ -2.451330229824e-14 -4.758464563776e-14 -2.24304726912e-15 ] ] } "relaxed-potential-energy" { "source-value" -25.011241 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.007242558739441e-18 } }