{ "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" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.5459029 5.809505 -3.3745049 ] [ -4.2414447 -2.4227843 6.792883 ] [ -7.9922942 -5.9173912 -0.4324516 ] [ 4.3452352 -4.7160367 -10.1023598 ] [ 14.7276898 -8.3157213 0.659711 ] [ -0.7354513 11.156122 9.9880574 ] [ 4.4421681 4.4063064 -3.5313351 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.689639907160692e-08 9.307853089420703e-09 -5.406552857555041e-09 ] [ -6.79554353675607e-09 -3.881728362701294e-09 1.088339833042977e-08 ] [ -1.280506691379544e-08 -9.480705836767657e-09 -6.928638431475533e-10 ] [ 6.961834249317213e-09 -7.555923743574783e-09 -1.618576468646976e-08 ] [ 2.359636027595463e-08 -1.332325425194858e-08 1.056973540684589e-09 ] [ -1.178322878596967e-09 1.787407784719254e-08 1.600263205348844e-08 ] [ 7.117137875483556e-09 7.059681098161413e-09 -5.65782253743043e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 13.709021 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.196427294025624e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7294602 2.7511608 2.7616979 ] [ 2.6933134 0.7546996 5.7876181 ] [ 1.828744 0.2046347 3.3225919 ] [ 3.8502943 1.0419017 1.7050539 ] [ 4.6362114 0.6289418 4.1693356 ] [ 3.4348222 3.0292064 4.7708998 ] [ 4.2542616 3.5528575 2.3483959 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7294602e-10 2.7511608e-10 2.7616979e-10 ] [ 2.6933134e-10 7.546996e-11 5.787618100000001e-10 ] [ 1.828744e-10 2.046347e-11 3.3225919e-10 ] [ 3.8502943e-10 1.0419017e-10 1.7050539e-10 ] [ 4.6362114e-10 6.289418e-11 4.1693356e-10 ] [ 3.434822200000001e-10 3.0292064e-10 4.7708998e-10 ] [ 4.254261600000001e-10 3.5528575e-10 2.3483959e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.7785671 -3.1818291 2.1740818 ] [ -0.0796473 0.4982724 -2.930534 ] [ -0.9992564 3.47758 1.6922496 ] [ 3.083615 2.3220629 2.7384094 ] [ -0.2927595 -0.2262524 -2.5605775 ] [ -0.8121826 0.0794033 -1.2812693 ] [ -0.1212021 -2.9692372 0.16764 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.247402005344056e-09 -5.097852195401105e-09 3.483263031666782e-09 ] [ -1.276090419698439e-10 7.98320390069906e-10 -4.695233061259508e-09 ] [ -1.600985242264773e-09 5.571697372961664e-09 2.711282745678152e-09 ] [ 4.940495860548192e-09 3.720354890407048e-09 4.387415518858956e-09 ] [ -4.690524264170976e-10 -3.624963056798899e-10 -4.102497406246512e-09 ] [ -1.301259973540558e-09 1.272181108743686e-10 -2.052819717408781e-09 ] [ -1.941871710118637e-10 -4.757242423449653e-09 2.68588888710912e-10 ] ] } "relaxed-potential-energy" { "source-value" -12.723187 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.038479275346649e-18 } }