{ "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" [ [ 0.0317926 0.0463887 1.270674 ] [ 0.0111454 2.887791 2.968384 ] [ 2.5478 0.1715431 0.0845133 ] [ 1.93577 0.0052704 2.481441 ] [ 2.875434 2.93696 0.1676441 ] [ 2.282488 2.689422 2.770272 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.17926e-12 4.63887e-12 1.270674e-10 ] [ 1.11454e-12 2.887791e-10 2.968384e-10 ] [ 2.5478e-10 1.715431e-11 8.451330000000001e-12 ] [ 1.93577e-10 5.270399999999999e-13 2.481441e-10 ] [ 2.875434e-10 2.93696e-10 1.676441e-11 ] [ 2.282488e-10 2.689422e-10 2.770272e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.464108 -0.0103059 -0.2802714 ] [ -0.0758852 0.0066275 0.0066189 ] [ 0.2840448 -0.0532573 0.9120931 ] [ 1.1800632 0.0635632 -0.6318216 ] [ 0.0 0.0 0.0 ] [ 0.0758852 -0.0066275 -0.0066189 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.345759627252472e-09 -1.65118721723406e-11 -4.490442882584676e-10 ] [ -1.215814943064168e-10 1.0618425641835e-11 1.06046469227826e-11 ] [ 4.550899415692032e-10 -8.53276016499282e-11 1.461334252852625e-09 ] [ 1.890669685683269e-09 1.018394738222688e-10 -1.012289804376494e-09 ] [ 0.0 0.0 0.0 ] [ 1.215814943064168e-10 -1.0618425641835e-11 -1.06046469227826e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -6.957485 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.114711989840549e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.5164835 0.0039846 1.764028 ] [ 0.0078779 2.8880764 2.968669 ] [ 3.2579977 0.1801942 0.1637775 ] [ 1.7738485 0.0390234 1.9088228 ] [ 2.875434 2.93696 0.1676441 ] [ 2.2857554 2.6891366 2.769987 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.164835e-11 3.9846e-13 1.764028e-10 ] [ 7.8779e-13 2.8880764e-10 2.968669e-10 ] [ 3.2579977e-10 1.801942e-11 1.637775e-11 ] [ 1.7738485e-10 3.90234e-12 1.9088228e-10 ] [ 2.875434e-10 2.93696e-10 1.676441e-11 ] [ 2.2857554e-10 2.6891366e-10 2.769987e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.6e-06 -3e-07 2e-06 ] [ -0.0 0.0 0.0 ] [ 1.25e-05 9e-07 -1.08e-05 ] [ -5e-06 -7e-07 8.8e-06 ] [ 0.0 0.0 0.0 ] [ 0.0 -0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.21765424184e-14 -4.806529901999999e-16 3.204353268e-15 ] [ 0.0 0.0 0.0 ] [ 2.0027207925e-14 1.4419589706e-15 -1.73035076472e-14 ] [ -8.010883169999999e-15 -1.1215236438e-15 1.40991543792e-14 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" -7.997936 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.281410617942742e-18 } }