{ "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" [ [ 2.10043 2.130682 2.453785 ] [ 1.948071 1.785129 4.606922 ] [ 2.343053 4.336787 1.957735 ] [ 4.413531 1.079857 2.965455 ] [ 3.524463 3.435576 3.796327 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.10043e-10 2.130682e-10 2.453785e-10 ] [ 1.948071e-10 1.785129e-10 4.606922e-10 ] [ 2.343053e-10 4.336787e-10 1.957735e-10 ] [ 4.413531e-10 1.079857e-10 2.965455e-10 ] [ 3.524463e-10 3.435576e-10 3.796327e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3237448 -7.615169 -6.3425346 ] [ -2.1687413 -2.3890757 4.2774748 ] [ -1.0587382 4.0287965 -2.8185442 ] [ -3.6648818 4.9942267 0.8261816 ] [ 9.2161062 0.9812215 4.0574225 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.723049621939003e-09 -1.220084583576115e-08 -1.016186073645654e-08 ] [ -3.474706636050784e-09 -3.827721263397193e-09 6.853270177083823e-09 ] [ -1.696285605563219e-09 6.454843615440981e-09 -4.515805659136222e-09 ] [ -5.87178798633186e-09 8.001633323638926e-09 1.323688854960734e-09 ] [ 1.476583001010253e-08 1.572090160078431e-09 6.500707523765865e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.512044 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.164868117437989e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.090635 1.8250128 2.3581214 ] [ 1.6963729 2.052701 4.7498675 ] [ 2.4342366 4.2164375 2.0569174 ] [ 4.4671535 1.3915475 2.6614382 ] [ 3.64115 3.2823322 3.9538794 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.090635e-10 1.8250128e-10 2.3581214e-10 ] [ 1.6963729e-10 2.052701e-10 4.7498675e-10 ] [ 2.4342366e-10 4.2164375e-10 2.0569174e-10 ] [ 4.467153500000001e-10 1.3915475e-10 2.6614382e-10 ] [ 3.64115e-10 3.2823322e-10 3.9538794e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.96e-05 4.05e-05 1e-05 ] [ -2.17e-05 3.17e-05 1.51e-05 ] [ -2.06e-05 -3.17e-05 -1.83e-05 ] [ 2.11e-05 3.04e-05 -1.67e-05 ] [ 1.7e-06 -7.09e-05 9.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.140266202639999e-14 6.4888153677e-14 1.602176634e-14 ] [ -3.476723295779999e-14 5.078899929779999e-14 2.41928671734e-14 ] [ -3.300483866039999e-14 -5.078899929779999e-14 -2.93198324022e-14 ] [ 3.38059269774e-14 4.870616967359999e-14 -2.67563497878e-14 ] [ 2.7237002778e-15 -1.135943233506e-13 1.58615486766e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.079847 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.5762755141695e-18 } }