{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.428537 1.662164 2.065612 ] [ 2.677805 2.654077 4.303636 ] [ 2.380622 3.799595 2.643621 ] [ 4.65403 2.78928 1.862185 ] [ 4.978196 2.955414 4.623231 ] [ 4.975087 5.409268 1.773954 ] [ 3.793479 4.953224 3.972917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.428537e-10 1.662164e-10 2.065612e-10 ] [ 2.677805e-10 2.654077e-10 4.303636e-10 ] [ 2.380622e-10 3.799595e-10 2.643621e-10 ] [ 4.65403e-10 2.78928e-10 1.862185e-10 ] [ 4.978196e-10 2.955414e-10 4.623231e-10 ] [ 4.975087000000001e-10 5.409268e-10 1.773954e-10 ] [ 3.793479e-10 4.953223999999999e-10 3.972917e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7210283 -0.6808028 -0.0859119 ] [ 0.2607509 -2.6482761 3.861072 ] [ -0.9213474 3.600294 -4.277437 ] [ 0.0142734 0.806543 0.3679546 ] [ -0.0034714 0.0953248 -0.8915357 ] [ -1.140827 -1.7416525 1.0990187 ] [ 1.0695933 0.5685695 -0.0731607 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.155214694712742e-09 -1.090766338521775e-09 -1.376460387625446e-10 ] [ 4.177689992744706e-10 -4.243006087800647e-09 6.186119340591647e-09 ] [ -1.476161276076651e-09 5.768306922330395e-09 -6.853209614807057e-09 ] [ 2.28685079677356e-11 1.292224348916262e-09 5.895282624928163e-10 ] [ -5.561795967267599e-12 1.527271672007232e-10 -1.428397666916834e-09 ] [ -1.827806362836318e-09 -2.790434940047685e-09 1.760822081469055e-09 ] [ 1.713677393142952e-09 9.109487677050629e-10 -1.172163640670838e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -18.94752 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.035727381624768e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7774126 1.9833641 2.0952302 ] [ 2.6428156 2.7666326 4.352405 ] [ 2.1561159 4.2622869 2.478576 ] [ 5.0763314 2.5978599 1.9885972 ] [ 5.0345274 2.8450956 4.3573808 ] [ 4.3760788 4.8685447 1.8223012 ] [ 3.8244743 4.8992383 4.1506655 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7774126e-10 1.9833641e-10 2.0952302e-10 ] [ 2.6428156e-10 2.7666326e-10 4.352405e-10 ] [ 2.1561159e-10 4.2622869e-10 2.478576e-10 ] [ 5.076331400000001e-10 2.5978599e-10 1.9885972e-10 ] [ 5.034527400000001e-10 2.8450956e-10 4.3573808e-10 ] [ 4.3760788e-10 4.8685447e-10 1.8223012e-10 ] [ 3.8244743e-10 4.899238300000001e-10 4.1506655e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.7e-06 -1.48e-05 -4.7e-06 ] [ -5.8e-06 1.03e-05 -2.3e-05 ] [ 2.4e-06 -4.2e-06 1.17e-05 ] [ 7.1e-06 5.5e-06 -6e-06 ] [ 7.4e-06 -2.8e-06 -4.6e-06 ] [ -7.2e-06 -2.17e-05 2.53e-05 ] [ 3.7e-06 2.78e-05 1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.23367600818e-14 -2.37122141832e-14 -7.530230179799999e-15 ] [ -9.2926244772e-15 1.65024193302e-14 -3.6850062582e-14 ] [ 3.845223921599999e-15 -6.729141862799999e-15 1.87454666178e-14 ] [ 1.13754541014e-14 8.811971486999999e-15 -9.613059803999999e-15 ] [ 1.18561070916e-14 -4.486094575199999e-15 -7.370012516399999e-15 ] [ -1.15356717648e-14 -3.476723295779999e-14 4.053506884019999e-14 ] [ 5.9280535458e-15 4.454051042519999e-14 2.0828296242e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.541441 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.451319343288959e-18 } }