{ "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" [ [ 1.152391 0.2084818 1.476287 ] [ 0.2004725 1.985654 1.37487 ] [ 0.8976264 2.29727 2.845471 ] [ 1.752289 1.001076 2.997864 ] [ 1.785348 1.533822 0.3428561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.152391e-10 2.084818e-11 1.476287e-10 ] [ 2.004725e-11 1.985654e-10 1.37487e-10 ] [ 8.976264000000001e-11 2.29727e-10 2.845471e-10 ] [ 1.752289e-10 1.001076e-10 2.997864e-10 ] [ 1.785348e-10 1.533822e-10 3.428561e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.6584946 -30.0219696 -5.8244137 ] [ -29.7364309 5.2312474 -25.4029159 ] [ -12.1045295 47.5343617 26.6976093 ] [ 33.5883292 -32.2015939 22.1270699 ] [ 15.9111257 9.4579543 -17.5973497 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.227026109973518e-08 -4.810049819977832e-08 -9.331739536889484e-09 ] [ -4.764301476653558e-08 8.38138235095325e-09 -4.069995829044708e-08 ] [ -1.93935943304637e-08 7.61584436278445e-08 4.277428580412109e-08 ] [ 5.38144362193399e-08 -5.159264132413692e-08 3.545147437266471e-08 ] [ 2.549243381717689e-08 1.515331338489983e-08 -2.819406250966691e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 19.932198 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.193490189986153e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7706846 -0.2107672 1.3418627 ] [ -0.2179153 2.1388383 0.9882766 ] [ 0.6150874 2.6970518 3.3269588 ] [ 2.4190761 0.9433314 2.9461917 ] [ 2.2011941 1.4578494 0.4340583 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.706846000000001e-11 -2.107672e-11 1.3418627e-10 ] [ -2.179153e-11 2.1388383e-10 9.882766e-11 ] [ 6.150874e-11 2.6970518e-10 3.3269588e-10 ] [ 2.4190761e-10 9.433314e-11 2.9461917e-10 ] [ 2.2011941e-10 1.4578494e-10 4.340583000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.44e-05 8.1e-06 -3.1e-06 ] [ 1.91e-05 -4.6e-06 2.45e-05 ] [ -1.01e-05 8.8e-06 -8.1e-06 ] [ -1.73e-05 -7e-07 -3.25e-05 ] [ -6.1e-06 -1.17e-05 1.93e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.30713435296e-14 1.29776307354e-14 -4.9667475654e-15 ] [ 3.06015737094e-14 -7.370012516399999e-15 3.925332753299999e-14 ] [ -1.61819840034e-14 1.40991543792e-14 -1.29776307354e-14 ] [ -2.77176557682e-14 -1.1215236438e-15 -5.207074060499999e-14 ] [ -9.773277467399999e-15 -1.87454666178e-14 3.09220090362e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.452824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.155380027411441e-18 } }