{ "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" [ [ 0.0647644 0.143829 0.6473224 ] [ 1.313892 1.683397 0.0769283 ] [ 0.1194939 2.399252 1.546304 ] [ 2.728192 0.2406182 0.1106797 ] [ 2.458193 2.956348 2.547264 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.47644e-12 1.43829e-11 6.473223999999999e-11 ] [ 1.313892e-10 1.683397e-10 7.69283e-12 ] [ 1.194939e-11 2.399252e-10 1.546304e-10 ] [ 2.728192e-10 2.406182e-11 1.106797e-11 ] [ 2.458193e-10 2.956348e-10 2.547264000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7463359 -2.7791723 0.9098332 ] [ 2.6082656 5.1577101 -2.752569 ] [ 1.0396058 2.3323553 4.7347631 ] [ 2.3658921 -2.6221427 0.6310559 ] [ -4.2674278 -2.0887503 -3.5230832 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.797938551043726e-09 -4.452724884234964e-09 1.45771348186765e-09 ] [ 4.178902165156884e-09 8.26356253908403e-09 -4.410101698938835e-09 ] [ 1.665632107608081e-09 3.736845133058971e-09 7.585926743846534e-09 ] [ 3.790577009955415e-09 -4.201135730341389e-09 1.011063009397903e-09 ] [ -6.837173052111978e-09 -3.346546897348987e-09 -5.64460153617325e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.213822 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.95687000590127e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2339701 0.2125145 0.6113692 ] [ 1.3599833 2.2285764 -0.2388924 ] [ 0.0496598 2.2472868 1.8438925 ] [ 2.6126153 0.3501635 0.7397767 ] [ 2.4283068 2.384903 1.9723523 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.339701e-11 2.125145e-11 6.113692e-11 ] [ 1.3599833e-10 2.2285764e-10 -2.388924e-11 ] [ 4.96598e-12 2.2472868e-10 1.8438925e-10 ] [ 2.6126153e-10 3.501635000000001e-11 7.397767e-11 ] [ 2.4283068e-10 2.384903e-10 1.9723523e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.81e-05 1.52e-05 -1.02e-05 ] [ 9.5e-06 -1.93e-05 1.69e-05 ] [ 3.81e-05 -1.27e-05 6.7e-06 ] [ -3.22e-05 1.14e-05 4.4e-06 ] [ -3.34e-05 5.4e-06 -1.78e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.899939683648e-14 2.435308463616e-14 -1.634220153216e-14 ] [ 1.52206778976e-14 -3.092200878144e-14 2.707678489152e-14 ] [ 6.104292925248e-14 -2.034764308416e-14 1.073458335936e-14 ] [ -5.159008718975999e-14 1.826481347712e-14 7.04957713152e-15 ] [ -5.351269913472e-14 8.65175375232e-15 -2.851874385024e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }