{ "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" [ [ 0.8070865 2.620947 2.881943 ] [ 2.981493 2.883992 2.450576 ] [ 2.14387 2.287305 4.61196 ] [ 1.117537 4.809867 2.516966 ] [ 2.97789 5.94727 2.412215 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.070865000000001e-11 2.620947e-10 2.881943e-10 ] [ 2.981493e-10 2.883992e-10 2.450576e-10 ] [ 2.14387e-10 2.287305e-10 4.61196e-10 ] [ 1.117537e-10 4.809867e-10 2.516966e-10 ] [ 2.97789e-10 5.947269999999999e-10 2.412215e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7428375 -1.348931 -0.577643 ] [ -0.7481049 5.2603504 0.256049 ] [ 1.1031169 -0.0798496 0.6036107 ] [ 0.0187324 -2.3343568 -0.1935138 ] [ 2.369093 -1.497213 -0.088503 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.394510153358974e-09 -2.161225729078254e-09 -9.254861173936619e-10 ] [ -1.198596190560906e-09 8.428010497532553e-09 4.10235724959066e-10 ] [ 1.767388121750514e-09 -1.279331633542464e-10 9.670909595723836e-10 ] [ 3.00126135787416e-11 -3.740051920379011e-09 -3.100432887165492e-10 ] [ 3.795705448372961e-09 -2.398799684721042e-09 -1.41797438638902e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -15.116013 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.421852282784024e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7634798 2.2539136 2.8558343 ] [ 2.7714096 3.1361771 1.9995308 ] [ 2.2331253 3.4085247 4.2877669 ] [ 1.0121953 4.5849249 2.6368913 ] [ 3.2476666 5.1658407 3.0936368 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.634798000000001e-11 2.2539136e-10 2.8558343e-10 ] [ 2.7714096e-10 3.1361771e-10 1.9995308e-10 ] [ 2.2331253e-10 3.4085247e-10 4.2877669e-10 ] [ 1.0121953e-10 4.5849249e-10 2.6368913e-10 ] [ 3.2476666e-10 5.1658407e-10 3.0936368e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.97e-05 -2.7e-06 -7e-06 ] [ 1.5e-05 -2.18e-05 -8.2e-06 ] [ -3.74e-05 -1.4e-06 -1e-07 ] [ -1.5e-05 1.43e-05 3.6e-05 ] [ 1.76e-05 1.17e-05 -2.07e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.15628796898e-14 -4.3258769118e-15 -1.1215236438e-14 ] [ 2.403264951e-14 -3.492745062119999e-14 -1.31378483988e-14 ] [ -5.99214061116e-14 -2.2430472876e-15 -1.602176634e-16 ] [ -2.403264951e-14 2.29111258662e-14 5.7678358824e-14 ] [ 2.81983087584e-14 1.87454666178e-14 -3.316505632379999e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.398784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.268245508681305e-18 } }