{ "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" [ [ 0.148581 1.499098 2.912634 ] [ 0.4436014 1.560152 0.6683764 ] [ 2.110053 0.4783189 0.3653162 ] [ 2.063967 1.021193 2.434749 ] [ 2.249538 2.67297 1.348927 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.48581e-11 1.499098e-10 2.912634e-10 ] [ 4.436014e-11 1.560152e-10 6.683764e-11 ] [ 2.110053e-10 4.783189e-11 3.653162e-11 ] [ 2.063967e-10 1.021193e-10 2.434749e-10 ] [ 2.249538e-10 2.67297e-10 1.348927e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.6755811 0.9081183 4.5328478 ] [ -17.3118716 4.6248076 -10.8623127 ] [ 5.9035608 -17.8119393 -10.8465556 ] [ 12.1736756 -9.7661543 15.3670097 ] [ 5.9102163 22.0451676 1.8090109 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.069545996867435e-08 1.454965909180641e-09 7.262422770804714e-09 ] [ -2.773667593981149e-08 7.409758612418158e-09 -1.740334345575893e-08 ] [ 9.458547093231345e-09 -2.853787271756872e-08 -1.737809779852732e-08 ] [ 1.950437843552341e-08 -1.564710409458539e-08 2.462066367294682e-08 ] [ 9.46921037973108e-09 3.532025213033764e-08 2.898354970752367e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.2743691 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.246117619889938e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.6585466 1.3370003 2.206218 ] [ -0.0424982 0.3101009 0.39079 ] [ 0.0724985 -0.4201911 -1.6819994 ] [ 2.2004647 2.4875772 3.2766305 ] [ 4.1267287 3.5172445 3.5383636 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.585466e-11 1.3370003e-10 2.206218e-10 ] [ -4.24982e-12 3.101009e-11 3.907900000000001e-11 ] [ 7.24985e-12 -4.201911e-11 -1.6819994e-10 ] [ 2.2004647e-10 2.4875772e-10 3.2766305e-10 ] [ 4.1267287e-10 3.5172445e-10 3.5383636e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1256869 0.0982212 0.0989573 ] [ -0.0399874 -0.0717629 -0.138347 ] [ -0.0355843 -0.0047396 0.0328364 ] [ -0.1132465 -0.069135 -0.0380847 ] [ 0.0631313 0.0474162 0.0446381 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.013726127208275e-10 1.57367710306921e-10 1.585470725174918e-10 ] [ -6.406687740657791e-11 -1.149768406208083e-10 -2.216563289578176e-10 ] [ -5.701233352753344e-11 -7.593676311943681e-12 5.260971239123712e-11 ] [ -1.814408946874272e-10 -1.10766480679008e-10 -6.101841595018176e-11 ] [ 1.01147492900711e-10 7.596912708717696e-11 7.151812021693249e-11 ] ] } "relaxed-potential-energy" { "source-value" -11.145013 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.785627926711207e-18 } }