{ "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" [ [ 1.26541 0.4689135 1.770405 ] [ 0.1075881 2.160004 0.6716672 ] [ 0.5668509 2.899878 2.242644 ] [ 2.824031 1.222886 2.646945 ] [ 2.932592 2.399832 0.52394 ] [ 1.820297 2.092873 2.325497 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26541e-10 4.689135e-11 1.770405e-10 ] [ 1.075881e-11 2.160004e-10 6.716672e-11 ] [ 5.668509000000001e-11 2.899878e-10 2.242644e-10 ] [ 2.824031e-10 1.222886e-10 2.646945e-10 ] [ 2.932592e-10 2.399832e-10 5.2394e-11 ] [ 1.820297e-10 2.092873e-10 2.325497e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.7753591 -38.909532 -11.7193509 ] [ -13.6708078 -5.5919639 -20.7055024 ] [ -54.2852337 48.6360427 12.9299413 ] [ 85.6444193 -60.0014982 34.0237354 ] [ 9.031703 6.5588579 -9.0003015 ] [ -5.9447217 49.3080934 -5.5285218 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.328579491297926e-08 -6.233994301027528e-08 -1.877647017762687e-08 ] [ -2.190304882506494e-08 -8.95931389875151e-09 -3.317387214051092e-08 ] [ -8.697453300536936e-08 7.792353118416627e-08 2.071604982985158e-08 ] [ 1.372174874349586e-07 -9.613299842103305e-08 5.451203385927864e-08 ] [ 1.44703835118277e-08 1.050844887310631e-08 -1.442007276225515e-08 ] [ -9.524494203372756e-09 7.90002751125696e-08 -8.857668448519621e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 48.598043 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.786264895272724e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5904614 -0.4633622 2.2013022 ] [ -0.924033 1.2364107 1.7407228 ] [ 0.2860919 3.1773946 1.3378786 ] [ 2.7281178 0.4366037 2.0805265 ] [ 4.2869182 4.1659943 1.2744574 ] [ 2.5492128 2.6913454 1.5462106 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.904614e-11 -4.633622e-11 2.2013022e-10 ] [ -9.24033e-11 1.2364107e-10 1.7407228e-10 ] [ 2.860919e-11 3.1773946e-10 1.3378786e-10 ] [ 2.7281178e-10 4.366037e-11 2.0805265e-10 ] [ 4.2869182e-10 4.1659943e-10 1.2744574e-10 ] [ 2.5492128e-10 2.6913454e-10 1.5462106e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.15e-05 -1.8e-05 -2e-07 ] [ 7.1e-06 -3e-07 3.1e-06 ] [ 6.7e-06 -2.5e-06 0.0 ] [ -6.3e-06 1.16e-05 3e-07 ] [ 1.26e-05 1.02e-05 -2.3e-06 ] [ -8.6e-06 -1e-06 -9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.8425031291e-14 -2.8839179412e-14 -3.204353268e-16 ] [ 1.13754541014e-14 -4.806529901999999e-16 4.9667475654e-15 ] [ 1.07345834478e-14 -4.005441585e-15 0.0 ] [ -1.00937127942e-14 1.85852489544e-14 4.806529901999999e-16 ] [ 2.01874255884e-14 1.63422016668e-14 -3.685006258199999e-15 ] [ -1.37787190524e-14 -1.602176634e-15 -1.4419589706e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.100801 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.419415051688383e-18 } }