{ "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" [ [ 1.497272 0.041495 0.0459008 ] [ 0.5144624 2.623314 0.1336692 ] [ 0.1881884 1.665255 2.217108 ] [ 2.303156 0.3070008 2.474488 ] [ 2.009269 2.269424 0.9602388 ] [ 2.927445 2.103094 2.701001 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.497272e-10 4.1495e-12 4.59008e-12 ] [ 5.144624e-11 2.623314e-10 1.336692e-11 ] [ 1.881884e-11 1.665255e-10 2.217108e-10 ] [ 2.303156e-10 3.070008e-11 2.474488e-10 ] [ 2.009269e-10 2.269424e-10 9.602388e-11 ] [ 2.927445e-10 2.103094e-10 2.701001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4955555 -1.0554625 -0.123967 ] [ -10.6677034 3.6264324 -6.9582193 ] [ -5.8042955 -1.4057898 3.7133068 ] [ -1.3038584 -9.8021453 1.5386143 ] [ 11.0507521 2.808923 -4.4696616 ] [ 6.2295497 5.8280421 6.2999268 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.939674364088545e-10 -1.69103734163112e-09 -1.986170291507136e-10 ] [ -1.709154498510867e-08 5.810185208191634e-09 -1.114829628485934e-08 ] [ -9.299506550314648e-09 -2.252323551319108e-09 5.949373340817661e-09 ] [ -2.089011445313695e-09 -1.57047680333446e-08 2.465131859888557e-09 ] [ 1.77052566568765e-08 4.500390760227398e-09 -7.161187318407522e-09 ] [ 9.980838887451654e-09 9.337552797658136e-09 1.009359543171136e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.4023166 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.451112113079745e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.799612 0.2950512 0.0855613 ] [ 0.2689982 2.1805977 0.3585543 ] [ 0.2470928 1.8361189 2.614778 ] [ 1.7777069 -0.0494312 2.341785 ] [ 2.6841396 2.5458687 0.4377526 ] [ 2.6622433 2.2013775 2.6939747 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.799612e-10 2.950512e-11 8.556130000000001e-12 ] [ 2.689982e-11 2.1805977e-10 3.585543e-11 ] [ 2.470928e-11 1.8361189e-10 2.614778e-10 ] [ 1.7777069e-10 -4.94312e-12 2.341785e-10 ] [ 2.6841396e-10 2.5458687e-10 4.377526e-11 ] [ 2.6622433e-10 2.2013775e-10 2.6939747e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.4e-06 -2.92e-05 -8.3e-06 ] [ -1.91e-05 1.14e-05 3e-06 ] [ 1.19e-05 4.1e-06 2.3e-06 ] [ -7e-07 -3.3e-06 -1.25e-05 ] [ 1.07e-05 1.9e-06 9.1e-06 ] [ -8.1e-06 1.52e-05 6.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.65175375232e-15 -4.678355732736e-14 -1.329806595264e-14 ] [ -3.060157345728e-14 1.826481347712e-14 4.8065298624e-15 ] [ 1.906590178752e-14 6.568924145279999e-15 3.68500622784e-15 ] [ -1.12152363456e-15 -5.28718284864e-15 -2.002720776e-14 ] [ 1.714328984256e-14 3.04413557952e-15 1.457980724928e-14 ] [ -1.297763062848e-14 2.435308463616e-14 1.025393037312e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.567729 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853354495955016e-18 } }