{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.635409 0.2945373 0.4894103 ] [ 0.6913641 0.4672635 2.355287 ] [ 2.952385 0.4157679 2.192681 ] [ 2.385934 1.774442 0.4759126 ] [ 2.093707 2.943435 1.550224 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.35409e-11 2.945373e-11 4.894103e-11 ] [ 6.913641e-11 4.672635e-11 2.355287e-10 ] [ 2.952385e-10 4.157679e-11 2.192681e-10 ] [ 2.385934000000001e-10 1.774442e-10 4.759126e-11 ] [ 2.093707e-10 2.943435e-10 1.550224e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.7819008 -1.7677393 -9.134122 ] [ -4.5721923 -2.6320966 10.1142 ] [ 6.3557433 -4.0562968 4.9257939 ] [ 6.4869565 -8.3703811 -16.6318741 ] [ -3.4886066 16.8265138 10.7260021 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.661449664744817e-09 -2.832230578129357e-09 -1.463447671993494e-08 ] [ -7.325459608861781e-09 -4.217083636207169e-09 1.620473477809536e-08 ] [ 1.018302332306624e-08 -6.498903899985854e-09 7.891991825459254e-09 ] [ 1.03932500444466e-08 -1.341082890560619e-08 -2.664719984310904e-08 ] [ -5.589363933688577e-09 2.695904701992857e-08 1.718494979927171e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.74105232 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.1872967018936e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5691218 0.3911322 0.2636706 ] [ 0.8077354 0.8266405 2.6260288 ] [ 3.0904052 0.1895572 2.1667855 ] [ 2.6957789 1.5315402 0.1993752 ] [ 1.5957578 2.9565755 1.8076547 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.691218000000001e-11 3.911322e-11 2.636706e-11 ] [ 8.077354e-11 8.266405e-11 2.6260288e-10 ] [ 3.0904052e-10 1.895572e-11 2.1667855e-10 ] [ 2.6957789e-10 1.5315402e-10 1.993752e-11 ] [ 1.5957578e-10 2.9565755e-10 1.8076547e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-07 3.6e-06 4.1e-06 ] [ 6.4e-06 -9.8e-06 8.2e-06 ] [ -1.45e-05 3.4e-06 -4e-06 ] [ 1.55e-05 -3.2e-06 -6.8e-06 ] [ -6.9e-06 5.9e-06 -1.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883104e-16 5.76783583488e-15 6.568924145279999e-15 ] [ 1.025393037312e-14 -1.570133088384e-14 1.313784829056e-14 ] [ -2.32315610016e-14 5.44740051072e-15 -6.4087064832e-15 ] [ 2.48337376224e-14 -5.126965186560001e-15 -1.089480102144e-14 ] [ -1.105501868352e-14 9.45284206272e-15 -2.4032649312e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.3509582 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.337970998931805e-18 } }