{ "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" [ [ 2.719922 0.6324479 2.001085 ] [ 1.570016 2.535953 2.950979 ] [ 1.512501 2.471908 5.050939 ] [ 3.556391 2.380181 1.668166 ] [ 3.168972 1.023761 5.396195 ] [ 4.64835 1.331065 3.67677 ] [ 3.603196 3.529371 4.833641 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.719922e-10 6.324478999999999e-11 2.001085e-10 ] [ 1.570016e-10 2.535953e-10 2.950979e-10 ] [ 1.512501e-10 2.471908e-10 5.050939e-10 ] [ 3.556391e-10 2.380181e-10 1.668166e-10 ] [ 3.168972e-10 1.023761e-10 5.396195e-10 ] [ 4.64835e-10 1.331065e-10 3.67677e-10 ] [ 3.603196e-10 3.529371e-10 4.833641e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.185347 -7.6223539 0.0503874 ] [ -4.1777483 2.1482434 -2.8176748 ] [ -3.3244793 0.9024209 3.7181346 ] [ 4.6328438 6.0757306 -2.6098898 ] [ 1.0253752 -3.0301215 2.1795283 ] [ 2.1342066 -0.093625 -0.2974891 ] [ 1.895149 1.6197055 -0.2229966 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.501311871735418e-09 -1.22123572140437e-08 8.072951426289792e-11 ] [ -6.693490653846946e-09 3.441865351267903e-09 -4.514412689577316e-09 ] [ -5.326403010793549e-09 1.445837668101295e-09 5.95710832910756e-09 ] [ 7.422634024178231e-09 9.734393521599156e-09 -4.181504420424388e-09 ] [ 1.642832172988124e-09 -4.854789825483427e-09 3.491989286631969e-09 ] [ 3.419375918477057e-09 -1.500037861224e-10 -4.766300809628334e-10 ] [ 3.036363420732499e-09 2.595054284681174e-09 -3.572799390378892e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -15.685523 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.513097823562068e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7199076 0.4004868 2.5298549 ] [ 1.2072465 2.3815488 2.7264388 ] [ 1.7631063 2.6810982 5.0734225 ] [ 3.5495509 2.8910453 2.0155277 ] [ 2.8291762 0.4974596 5.0258683 ] [ 4.830782 1.4027036 3.8319302 ] [ 3.8795785 3.6503446 4.3747325 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7199076e-10 4.004868e-11 2.5298549e-10 ] [ 1.2072465e-10 2.3815488e-10 2.7264388e-10 ] [ 1.7631063e-10 2.6810982e-10 5.0734225e-10 ] [ 3.5495509e-10 2.8910453e-10 2.0155277e-10 ] [ 2.8291762e-10 4.974596e-11 5.025868300000001e-10 ] [ 4.830782e-10 1.4027036e-10 3.8319302e-10 ] [ 3.8795785e-10 3.6503446e-10 4.3747325e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.1e-05 2.47e-05 3.5e-05 ] [ 8.49e-05 -9e-06 2.89e-05 ] [ 2.7e-05 -2.52e-05 -3.16e-05 ] [ -1.04e-05 -5.26e-05 7.3e-05 ] [ 1.14e-05 6.61e-05 -7.15e-05 ] [ -5.62e-05 3.79e-05 -2.13e-05 ] [ -3.57e-05 -4.19e-05 -1.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.36457090368e-14 3.957376253376001e-14 5.6076181728e-14 ] [ 1.3602479510592e-13 -1.44195895872e-14 4.630290434112001e-14 ] [ 4.32587687616e-14 -4.037485084416e-14 -5.062878121728e-14 ] [ -1.666263685632e-14 -8.427449025408001e-14 1.169588933184e-13 ] [ 1.826481347712e-14 1.0590387463488e-13 -1.145556283872e-13 ] [ -9.004232608896e-14 6.072249392832e-14 -3.412636202304e-14 ] [ -5.719770536256001e-14 -6.713120041152e-14 -1.986699009792e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.651699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148549269679874e-18 } }