{ "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" [ [ 0.4314663 0.9036294 0.7794334 ] [ 1.004832 0.4139501 2.5602 ] [ 0.3021018 2.478458 1.913452 ] [ 2.709186 0.4632097 1.441964 ] [ 2.312911 2.26354 0.6044428 ] [ 2.800336 2.901369 2.552849 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.314663000000001e-11 9.036294e-11 7.794334000000001e-11 ] [ 1.004832e-10 4.139501e-11 2.5602e-10 ] [ 3.021018e-11 2.478458e-10 1.913452e-10 ] [ 2.709186e-10 4.632097e-11 1.441964e-10 ] [ 2.312911e-10 2.26354e-10 6.044428e-11 ] [ 2.800336e-10 2.901369e-10 2.552849e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.2749816 -7.2038453 -18.7071518 ] [ -2.1153253 -6.0480586 16.6317412 ] [ -2.7526871 11.7732582 6.9099264 ] [ 9.4186703 -7.7720088 -0.4500882 ] [ 0.5400767 7.318912 -8.4658231 ] [ 1.184247 1.9317425 4.0813955 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.005362881547018e-08 -1.154183251951996e-08 -2.997216125571663e-08 ] [ -3.389124741046746e-09 -9.690058090148378e-09 2.664698691383614e-08 ] [ -4.410290915997752e-09 1.886283903868189e-08 1.107092252952871e-08 ] [ 1.509037335368332e-08 -1.245213079601186e-08 -7.211207913379546e-10 ] [ 8.652982621788153e-10 1.172618969609257e-08 -1.356374384664858e-08 ] [ 1.897372856652538e-09 3.094992670905744e-09 6.539116450338327e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.0253026 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.285795220056545e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3758907 0.7955397 0.4078254 ] [ 0.8821734 0.3583013 2.7760193 ] [ 0.4648396 2.6232847 2.1612978 ] [ 2.8962461 0.3238502 1.502611 ] [ 2.2037236 2.3432552 0.3746315 ] [ 2.7379598 2.9799252 2.6299561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.758907e-11 7.955397e-11 4.078254e-11 ] [ 8.821734000000001e-11 3.583013e-11 2.7760193e-10 ] [ 4.648396e-11 2.6232847e-10 2.1612978e-10 ] [ 2.8962461e-10 3.238502e-11 1.502611e-10 ] [ 2.2037236e-10 2.3432552e-10 3.746315e-11 ] [ 2.7379598e-10 2.9799252e-10 2.6299561e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.3635186 -0.0431973 0.3162222 ] [ -0.0193425 -0.4668083 -0.3436889 ] [ -0.3907767 0.0052623 -0.1329608 ] [ -0.1095548 0.3076011 0.1875831 ] [ 0.3892958 -0.0415814 -0.0202473 ] [ 0.4938968 0.2387236 -0.0069082 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.824210021459469e-10 -6.920970414168383e-11 5.066438158179418e-10 ] [ -3.0990101287824e-11 -7.479093446553927e-10 -5.506503204084692e-10 ] [ -6.260932926933754e-10 8.431134031635841e-12 -2.130266852428646e-10 ] [ -1.755261392564199e-10 4.928312909523629e-10 3.005412572771885e-10 ] [ 6.237206293356326e-10 -6.662074694013311e-11 -3.243975069432384e-11 ] [ 7.913099060479335e-10 3.824773707532109e-10 -1.106815653181056e-11 ] ] } "relaxed-potential-energy" { "source-value" -16.866725 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.702347246446288e-18 } }