{ "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" [ [ 1.919195 1.598632 0.607522 ] [ 2.894266 0.8592219 2.792014 ] [ 2.250891 3.034774 3.11288 ] [ 5.028948 2.389792 2.243338 ] [ 4.250492 2.740815 4.381763 ] [ 4.34969 4.079675 2.747402 ] [ 3.264148 3.629997 0.8600408 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.919195e-10 1.598632e-10 6.07522e-11 ] [ 2.894266e-10 8.592219e-11 2.792014e-10 ] [ 2.250891e-10 3.034774e-10 3.11288e-10 ] [ 5.028948e-10 2.389792e-10 2.243338e-10 ] [ 4.250492000000001e-10 2.740815e-10 4.381763e-10 ] [ 4.34969e-10 4.079675e-10 2.747402e-10 ] [ 3.264148e-10 3.629997e-10 8.600408e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8924291 0.175831 0.8157437 ] [ 0.5941589 0.3808453 -1.5711634 ] [ -2.711672 1.441151 1.0203662 ] [ 3.3199534 -5.6344448 -2.72194 ] [ -0.3540496 -1.256586 2.1548393 ] [ -0.8066437 6.4578656 0.7967678 ] [ -0.9341761 -1.5646619 -0.4946137 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.429829051521649e-09 2.81712319732854e-10 1.306965495472706e-09 ] [ 9.519475064631427e-10 6.101814408287202e-10 -2.517281287675996e-09 ] [ -4.344577517472048e-09 2.308978458265734e-09 1.634806883763371e-09 ] [ 5.319151763448855e-09 -9.027375804122802e-09 -4.361028667149959e-09 ] [ -5.672499963970464e-10 -2.013272727811524e-09 3.452433176484916e-09 ] [ -1.292385688103305e-09 1.034664136983239e-08 1.276562751883585e-09 ] [ -1.496715119461247e-09 -2.506864736290044e-09 -7.924585129962856e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -16.790119005765543 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.690073635311686e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.189474 1.5505956 0.5293502 ] [ 2.7790333 0.7322716 2.6193352 ] [ 2.105613 2.9254408 3.2666418 ] [ 4.8100545 1.8610059 2.0869756 ] [ 4.3140113 2.920229 4.1641087 ] [ 4.4792623 4.8144591 2.833752 ] [ 3.2801816 3.5289049 1.2447964 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.189474e-10 1.5505956e-10 5.293502e-11 ] [ 2.7790333e-10 7.322716e-11 2.6193352e-10 ] [ 2.105613e-10 2.9254408e-10 3.2666418e-10 ] [ 4.8100545e-10 1.8610059e-10 2.0869756e-10 ] [ 4.3140113e-10 2.920229e-10 4.1641087e-10 ] [ 4.4792623e-10 4.8144591e-10 2.833752e-10 ] [ 3.2801816e-10 3.5289049e-10 1.2447964e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.8e-06 -2.95e-05 9.9e-06 ] [ -1.64e-05 -2.28e-05 -2.35e-05 ] [ 1.04e-05 -3.4e-06 3e-06 ] [ -2.53e-05 9.2e-06 -7.7e-06 ] [ 5.8e-06 2.17e-05 6.6e-06 ] [ 7.8e-06 1.13e-05 1.48e-05 ] [ 2.24e-05 1.34e-05 -3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.690447843199998e-15 -4.726421070299999e-14 1.58615486766e-14 ] [ -2.62756967976e-14 -3.65296272552e-14 -3.765115089899999e-14 ] [ 1.66626369936e-14 -5.4474005556e-15 4.806529901999999e-15 ] [ -4.053506884019999e-14 1.47400250328e-14 -1.23367600818e-14 ] [ 9.2926244772e-15 3.476723295779999e-14 1.05743657844e-14 ] [ 1.24969777452e-14 1.81045959642e-14 2.37122141832e-14 ] [ 3.588875660159999e-14 2.14691668956e-14 -4.9667475654e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.246676005765543 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.2438751212606e-18 } }