{ "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" [ [ 2.668149 2.195644 2.177876 ] [ 2.423331 4.799117 4.063095 ] [ 0.9419081 3.216694 3.792355 ] [ 4.815194 2.852634 0.7483411 ] [ 3.230766 2.566095 4.274755 ] [ 3.707939 4.705402 1.628358 ] [ 5.171828 3.316404 3.099703 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.668149e-10 2.195644e-10 2.177876e-10 ] [ 2.423331e-10 4.799117e-10 4.063095e-10 ] [ 9.419081e-11 3.216694e-10 3.792355e-10 ] [ 4.815194e-10 2.852634e-10 7.483411e-11 ] [ 3.230766e-10 2.566095e-10 4.274755e-10 ] [ 3.707939e-10 4.705402000000001e-10 1.628358e-10 ] [ 5.171828e-10 3.316404e-10 3.099703e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6943757 0.9977402 -4.5469609 ] [ 4.2559751 2.3694677 -4.467415 ] [ -1.8404808 -2.0109482 -1.076909 ] [ -0.3918971 -1.2691876 0.3204093 ] [ 1.7583421 -0.140774 3.179202 ] [ -3.9776589 -1.0307081 5.9467105 ] [ 1.8900954 1.08441 0.644963 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.714689155757393e-09 1.598556035242486e-09 -7.28503450969161e-09 ] [ 6.818823860105812e-09 3.796305783957721e-09 -7.157587927381109e-09 ] [ -2.948775333085627e-09 -3.221894218224358e-09 -1.725398436744306e-09 ] [ -6.278883765523614e-10 -2.033462716882538e-09 5.133522937762962e-10 ] [ 2.817174627198491e-09 -2.25544813474716e-10 5.093643159166068e-09 ] [ -6.372912147602142e-09 -1.651376434294535e-09 9.527680612262456e-09 ] [ 3.028266685910884e-09 1.73741636367594e-09 1.033344648394542e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.190558 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.074666362102177e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4683896 2.359687 1.8829008 ] [ 2.6210214 4.8335739 3.9782194 ] [ 1.0232526 3.1023598 3.693838 ] [ 4.7244259 2.6354639 1.0147343 ] [ 3.3638563 2.5046335 4.285228 ] [ 3.5431316 4.6891865 1.7711962 ] [ 5.2150379 3.5270854 3.1583664 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4683896e-10 2.359687e-10 1.8829008e-10 ] [ 2.6210214e-10 4.8335739e-10 3.9782194e-10 ] [ 1.0232526e-10 3.1023598e-10 3.693838e-10 ] [ 4.7244259e-10 2.6354639e-10 1.0147343e-10 ] [ 3.3638563e-10 2.5046335e-10 4.285228e-10 ] [ 3.5431316e-10 4.689186500000001e-10 1.7711962e-10 ] [ 5.215037899999999e-10 3.5270854e-10 3.1583664e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.1e-06 3.86e-05 -8e-07 ] [ 2.28e-05 2.87e-05 4e-07 ] [ -2.05e-05 -3.06e-05 -2.84e-05 ] [ -2.64e-05 1.2e-06 -8.9e-06 ] [ 4.07e-05 -2.2e-06 1.08e-05 ] [ -3.37e-05 -1.64e-05 -2.98e-05 ] [ 1.5e-05 -1.92e-05 5.67e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.364570931399999e-15 6.18440180724e-14 -1.2817413072e-15 ] [ 3.65296272552e-14 4.598246939579999e-14 6.408706536e-16 ] [ -3.2844620997e-14 -4.90266050004e-14 -4.550181640559999e-14 ] [ -4.22974631376e-14 1.9226119608e-15 -1.42593720426e-14 ] [ 6.520858900379999e-14 -3.5247885948e-15 1.73035076472e-14 ] [ -5.399335256579999e-14 -2.62756967976e-14 -4.77448636932e-14 ] [ 2.403264951e-14 -3.076179137279999e-14 9.08434151478e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.044279 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.371665209317688e-18 } }