{ "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" [ [ 1.570546 2.153895 2.543093 ] [ 2.524346 2.661693 4.212043 ] [ 2.241813 4.238266 2.673997 ] [ 3.729345 1.325386 1.859362 ] [ 4.629957 2.667135 3.458757 ] [ 3.970969 3.734581 1.387215 ] [ 4.050613 4.976756 3.428708 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.570546e-10 2.153895e-10 2.543093e-10 ] [ 2.524346e-10 2.661693e-10 4.212043000000001e-10 ] [ 2.241813e-10 4.238266e-10 2.673997e-10 ] [ 3.729345e-10 1.325386e-10 1.859362e-10 ] [ 4.629957e-10 2.667135e-10 3.458757e-10 ] [ 3.970969e-10 3.734581e-10 1.387215e-10 ] [ 4.050613e-10 4.976756e-10 3.428708e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.6712454 -7.2243423 -8.657833 ] [ 2.5626859 -0.3513312 12.6973035 ] [ -8.8906027 6.0922332 -2.5492494 ] [ -0.9426631 -2.4628073 -2.4764269 ] [ 4.8330998 -0.7640794 3.1310648 ] [ 3.1626042 -0.4232874 -6.0320817 ] [ 5.9461213 5.1336145 3.8872227 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.068851349955998e-08 -1.157467242907782e-08 -1.387137773367412e-08 ] [ 4.10587546926126e-09 -5.628946394351808e-10 2.034332298250642e-08 ] [ -1.424431590811731e-08 9.760833681919048e-09 -4.084347822918519e-09 ] [ -1.510312792554005e-09 -3.945852310104628e-09 -3.967673314989054e-09 ] [ 7.743479569350072e-09 -1.224190161200739e-09 5.016518862099883e-09 ] [ 5.067050551830262e-09 -6.781811817466115e-10 -9.664460354118997e-09 ] [ 9.526736609789703e-09 8.224957199863592e-09 6.228017381094392e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.473197 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.67799115166789e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5525913 1.8373168 2.4093023 ] [ 2.2663991 2.6651781 4.658783 ] [ 2.0977402 4.2678178 2.7321651 ] [ 3.8934306 1.6932216 1.7451495 ] [ 4.5940761 2.5056954 3.9531664 ] [ 3.7997675 3.98037 0.9075441 ] [ 4.5135841 4.8081123 3.1570645 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5525913e-10 1.8373168e-10 2.4093023e-10 ] [ 2.2663991e-10 2.6651781e-10 4.658783e-10 ] [ 2.0977402e-10 4.267817800000001e-10 2.7321651e-10 ] [ 3.8934306e-10 1.6932216e-10 1.7451495e-10 ] [ 4.5940761e-10 2.5056954e-10 3.9531664e-10 ] [ 3.7997675e-10 3.98037e-10 9.075441e-11 ] [ 4.5135841e-10 4.8081123e-10 3.1570645e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.08e-05 6.4e-05 -2.68e-05 ] [ -5.3e-06 -5.87e-05 3.3e-06 ] [ 1.18e-05 1.02e-05 -3.89e-05 ] [ 1.61e-05 -7.47e-05 2.26e-05 ] [ 3.72e-05 2.5e-06 -1.5e-06 ] [ -6.18e-05 -2.47e-05 4.8e-06 ] [ 2.27e-05 8.15e-05 3.65e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.332527398719999e-14 1.02539304576e-13 -4.293833379119999e-14 ] [ -8.4915361602e-15 -9.404776841579999e-14 5.2871828922e-15 ] [ 1.89056842812e-14 1.63422016668e-14 -6.232467106259999e-14 ] [ 2.579504380739999e-14 -1.196825945598e-13 3.62091919284e-14 ] [ 5.96009707848e-14 4.005441585e-15 -2.403264951e-15 ] [ -9.901451598119999e-14 -3.95737628598e-14 7.690447843199998e-15 ] [ 3.636940959179999e-14 1.30577395671e-13 5.847944714099999e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.65628 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.828847925936151e-18 } }