{ "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" [ [ 0.7315436 0.3767612 1.166558 ] [ 0.6069044 0.5624824 2.9402 ] [ 2.192795 0.1872249 0.2922769 ] [ 2.54678 0.883358 1.224646 ] [ 2.591807 0.3326772 2.854818 ] [ 2.523994 2.504234 0.7585561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.315436e-11 3.767612e-11 1.166558e-10 ] [ 6.069044000000001e-11 5.624824e-11 2.9402e-10 ] [ 2.192795e-10 1.872249e-11 2.922769e-11 ] [ 2.54678e-10 8.83358e-11 1.224646e-10 ] [ 2.591807e-10 3.326772e-11 2.854818e-10 ] [ 2.523994e-10 2.504234e-10 7.585561e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.8751552 -3.5910538 -3.7468345 ] [ -4.4622294 0.8586118 8.0872234 ] [ -4.5428378 -25.3280347 -35.8660242 ] [ 19.5019599 17.8325392 23.8199802 ] [ 4.7044286 -4.7206815 12.0313841 ] [ 1.6738338 14.948619 -4.325729 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.703697935656359e-08 -5.753502489796909e-09 -6.003090687365073e-09 ] [ -7.149279680227839e-09 1.375647763636681e-09 1.295716036541803e-08 ] [ -7.278428575211965e-09 -4.057998538148119e-08 -5.746370592771854e-08 ] [ 3.124558446898497e-08 2.857087763112905e-08 3.816381569878264e-08 ] [ 7.537325579241331e-09 -7.563365595856072e-09 1.927640247969912e-08 ] [ 2.681777403559429e-09 2.395032807236844e-08 -6.930581928816185e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 10.943538280772392 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.753348132673806e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2449578 0.7960239 0.4736425 ] [ 0.6321255 1.0332021 2.8611467 ] [ 2.1716739 -0.5395007 0.5170631 ] [ 3.731155 1.2184188 1.2018315 ] [ 2.6367445 -0.170926 2.8686516 ] [ 1.7771672 2.5095197 1.3147196 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.449578e-11 7.960239e-11 4.736425e-11 ] [ 6.321255e-11 1.0332021e-10 2.8611467e-10 ] [ 2.1716739e-10 -5.395007000000001e-11 5.170631e-11 ] [ 3.731155e-10 1.2184188e-10 1.2018315e-10 ] [ 2.6367445e-10 -1.70926e-11 2.8686516e-10 ] [ 1.7771672e-10 2.5095197e-10 1.3147196e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.95e-05 2.41e-05 -3.61e-05 ] [ -1.95e-05 -2.66e-05 2.14e-05 ] [ 2.89e-05 3.9e-06 4.17e-05 ] [ 4.1e-06 -9.2e-06 -5.1e-05 ] [ -6e-06 9e-06 6.8e-06 ] [ 1.2e-05 -1.3e-06 1.71e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.1242444363e-14 3.86124568794e-14 -5.783857648740001e-14 ] [ -3.1242444363e-14 -4.26178984644e-14 3.42865799676e-14 ] [ 4.63029047226e-14 6.248488872599999e-15 6.681076563779999e-14 ] [ 6.568924199399999e-15 -1.47400250328e-14 -8.171100833399999e-14 ] [ -9.613059803999999e-15 1.4419589706e-14 1.08948011112e-14 ] [ 1.9226119608e-14 -2.0828296242e-15 2.73972204414e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.509304719227607 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.64508222647324e-18 } }