{ "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" [ [ 0.5187931 0.2441636 0.2053746 ] [ -14.7144466 3.1534413 -8.8936526 ] [ -1.4863983 -0.2733046 1.8461706 ] [ -4.0590618 -10.0188508 -1.9979508 ] [ 10.6810766 -2.1222867 -2.2743147 ] [ 9.060037 9.0168372 11.1143729 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.311981758523565e-10 3.911932115703629e-10 3.290463826261517e-10 ] [ -2.357514233053005e-08 5.052369925925159e-09 -1.424920226923713e-08 ] [ -2.381472605456865e-09 -4.378822404770957e-10 2.957891373328309e-09 ] [ -6.503333918342366e-09 -1.605196851904337e-08 -3.201070061268657e-09 ] [ 1.711297121349396e-08 -3.400278133374783e-09 -3.643853840681766e-09 ] [ 1.451577946498297e-08 1.444656575539973e-08 1.78071884152331e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.8307477209180618 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.933181197037802e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7450001 0.3619576 0.0318105 ] [ 0.3441619 2.2050538 0.3017075 ] [ 0.3261518 1.8427724 2.6828387 ] [ 1.7270872 -0.0002615 2.4129526 ] [ 2.6577072 2.4811206 0.3609741 ] [ 2.6396845 2.1189399 2.7421224 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7450001e-10 3.619576e-11 3.18105e-12 ] [ 3.441619e-11 2.2050538e-10 3.017075e-11 ] [ 3.261518e-11 1.8427724e-10 2.6828387e-10 ] [ 1.7270872e-10 -2.615e-14 2.4129526e-10 ] [ 2.6577072e-10 2.4811206e-10 3.609741e-11 ] [ 2.6396845e-10 2.1189399e-10 2.7421224e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.47e-05 1e-06 -1e-07 ] [ -8e-06 -6.5e-06 -1.09e-05 ] [ 8.7e-06 1.36e-05 3.3e-06 ] [ -7.1e-06 2.1e-06 5e-07 ] [ -1.5e-05 3.8e-06 1.45e-05 ] [ 6.8e-06 -1.4e-05 -7.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.355199632576e-14 1.6021766208e-15 -1.6021766208e-16 ] [ -1.28174129664e-14 -1.04141480352e-14 -1.746372516672e-14 ] [ 1.393893660096e-14 2.178960204288e-14 5.28718284864e-15 ] [ -1.137545400768e-14 3.36457090368e-15 8.010883104e-16 ] [ -2.4032649312e-14 6.08827115904e-15 2.32315610016e-14 ] [ 1.089480102144e-14 -2.24304726912e-14 -1.169588933184e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.635338279081939 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.063098386184439e-18 } }