{ "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" [ [ 1.735137 1.403924 2.79869 ] [ 2.045924 2.694064 4.682831 ] [ 2.274394 3.585822 2.431289 ] [ 3.715465 2.312241 1.138099 ] [ 3.875208 1.089856 3.316209 ] [ 4.61535 3.47459 2.663723 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.735137e-10 1.403924e-10 2.79869e-10 ] [ 2.045924e-10 2.694064e-10 4.682831e-10 ] [ 2.274394e-10 3.585822e-10 2.431289e-10 ] [ 3.715465e-10 2.312241e-10 1.138099e-10 ] [ 3.875208e-10 1.089856e-10 3.316209e-10 ] [ 4.615350000000001e-10 3.47459e-10 2.663723e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.1435667 -2.3445982 -2.1256702 ] [ 1.2183367 -0.4917821 0.4974692 ] [ -1.4664898 3.4556945 0.4552948 ] [ -1.783105 -4.2881838 -4.1038232 ] [ 1.9365413 1.2647796 1.500881 ] [ 3.2382834 2.4040899 3.7758484 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.036549114160488e-09 -3.756460452158459e-09 -3.405699126030106e-09 ] [ 1.951990593084668e-09 -7.879217896394513e-10 7.970335283746727e-10 ] [ -2.349575691559333e-09 5.536632982142313e-09 7.29462690141703e-10 ] [ -2.85684916696857e-09 -6.870427886657328e-09 -6.575049641107108e-09 ] [ 3.102681221635984e-09 2.026400322279866e-09 2.404676468614554e-09 ] [ 5.188301997750075e-09 3.851776663815396e-09 6.049576080006285e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.086533 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.577346729466992e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6270299 1.3364448 2.5333576 ] [ 2.0462393 2.4747535 4.6522492 ] [ 2.3313261 3.7724598 2.5751257 ] [ 3.5151115 2.0603926 1.1261871 ] [ 3.9574778 1.3918687 3.5323032 ] [ 4.7842933 3.5245776 2.6116182 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6270299e-10 1.3364448e-10 2.5333576e-10 ] [ 2.0462393e-10 2.4747535e-10 4.6522492e-10 ] [ 2.3313261e-10 3.7724598e-10 2.5751257e-10 ] [ 3.5151115e-10 2.0603926e-10 1.1261871e-10 ] [ 3.9574778e-10 1.3918687e-10 3.5323032e-10 ] [ 4.7842933e-10 3.5245776e-10 2.6116182e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.07e-05 -1.45e-05 -1.09e-05 ] [ -4.6e-05 -2.37e-05 1.26e-05 ] [ -3.4e-06 0.0001746 -3.07e-05 ] [ -6.9e-06 -4.47e-05 2.03e-05 ] [ 0.0001029 -0.0001477 4.53e-05 ] [ -3.59e-05 5.6e-05 -3.65e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.71432899838e-14 -2.3231561193e-14 -1.74637253106e-14 ] [ -7.370012516399999e-14 -3.79715862258e-14 2.01874255884e-14 ] [ -5.4474005556e-15 2.797400402963999e-13 -4.91868226638e-14 ] [ -1.10550187746e-14 -7.16172955398e-14 3.252418567019999e-14 ] [ 1.648639756386e-13 -2.366414888418e-13 7.25786015202e-14 ] [ -5.751814116059999e-14 8.972189150399998e-14 -5.847944714099999e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.293287 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.930907699045596e-18 } }