{ "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" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.5811766 0.781151 -1.1304405 ] [ -4.3240404 -1.3224006 4.2612518 ] [ -2.1534342 -1.5994979 0.8556295 ] [ 1.5371363 -0.3796733 -2.8878159 ] [ 6.639267 -3.7862882 -2.6226839 ] [ 0.1076547 4.8366466 3.0023728 ] [ 1.7745932 1.4700624 -1.4783139 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.737677470747564e-09 1.251541879825734e-09 -1.811165355227277e-09 ] [ -6.927876493352014e-09 -2.11871934210758e-09 6.827278065550441e-09 ] [ -3.450181958096483e-09 -2.562678161512068e-09 1.370869592261103e-09 ] [ 2.462763863133214e-09 -6.083036898136721e-10 -4.62679115827368e-09 ] [ 1.063727845428728e-08 -6.066302483629919e-09 -4.202002862947992e-09 ] [ 1.724818448802798e-10 7.749162169435543e-09 4.810331546717155e-09 ] [ 2.843211759895289e-09 2.355299627801961e-09 -2.368519988297413e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.989141 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.241307483993139e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5622656 3.0301823 3.1154516 ] [ 2.6614169 0.6244412 5.3303091 ] [ 1.7712993 0.6036493 3.0609493 ] [ 4.0398613 0.7910446 2.1396041 ] [ 4.9709401 0.8195472 4.3922025 ] [ 3.54725 2.8722416 4.646384 ] [ 3.8740738 3.2222962 2.1806923 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5622656e-10 3.0301823e-10 3.1154516e-10 ] [ 2.6614169e-10 6.244412e-11 5.3303091e-10 ] [ 1.7712993e-10 6.036493e-11 3.0609493e-10 ] [ 4.0398613e-10 7.910446e-11 2.1396041e-10 ] [ 4.970940100000001e-10 8.195472000000001e-11 4.3922025e-10 ] [ 3.54725e-10 2.8722416e-10 4.646384000000001e-10 ] [ 3.8740738e-10 3.2222962e-10 2.1806923e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0018714 0.0102016 -5.48e-05 ] [ -0.039109 -0.0314838 0.017624 ] [ 0.0039534 -0.0119026 -0.0009794 ] [ -0.0048833 -0.0008028 0.0053614 ] [ 0.0461988 -0.0250894 -0.0140562 ] [ -0.006106 0.0553127 -0.0094247 ] [ -0.0019254 0.0037644 0.0015295 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.9983133528676e-12 1.63447651494144e-11 -8.779927954319999e-14 ] [ -6.265952597910599e-11 -5.044260870952919e-11 2.8236760997616e-11 ] [ 6.3340451048556e-12 -1.90700676038484e-11 -1.5691717953396e-12 ] [ -7.823909156812199e-12 -1.2862274017752e-12 8.5899098055276e-12 ] [ 7.40186378788392e-11 -4.01976504410796e-11 -2.25205152028308e-11 ] [ -9.782890527204e-12 8.862071550345179e-11 -1.51000341224598e-11 ] [ -3.0848308911036e-12 6.031233721029599e-12 2.450529161703e-12 ] ] } "relaxed-potential-energy" { "source-value" -17.656222 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.828838633311674e-18 } }