{ "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" [ [ 2.975716 3.919 3.294603 ] [ 5.229011 2.380728 1.260294 ] [ 3.72512 0.5184044 0.8589665 ] [ 3.15133 1.64182 3.064405 ] [ 5.039876 3.004083 3.766304 ] [ 5.090657 4.730463 1.850516 ] [ 3.207695 3.468122 0.7711985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.975716e-10 3.919e-10 3.294603e-10 ] [ 5.229011e-10 2.380728e-10 1.260294e-10 ] [ 3.72512e-10 5.184044e-11 8.589665e-11 ] [ 3.151330000000001e-10 1.64182e-10 3.064405e-10 ] [ 5.039876e-10 3.004083e-10 3.766304e-10 ] [ 5.090657000000001e-10 4.730463000000001e-10 1.850516e-10 ] [ 3.207695e-10 3.468122e-10 7.711985e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.4817897 5.0556817 4.1854356 ] [ 9.0568776 -4.8880954 -6.0060184 ] [ -1.3080032 -0.1499883 0.09538 ] [ -4.1919223 -7.5197441 2.3035226 ] [ 5.9037247 -1.1204914 8.2139587 ] [ 3.455552 6.7312094 -2.4555518 ] [ -5.4344392 1.8914281 -6.3367268 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.198714853908225e-08 8.1000950219464e-09 6.705807066184021e-09 ] [ 1.451071754816721e-08 -7.831592170120025e-09 -9.622702264574623e-09 ] [ -2.095652146971586e-09 -2.403077476535366e-10 1.52815606091904e-10 ] [ -6.716199905270164e-09 -1.204795819141874e-08 3.69065005520443e-09 ] [ 9.458809689979494e-09 -1.795225124887461e-09 1.316021259335676e-08 ] [ 5.536404626358682e-09 1.07845863303892e-08 -3.934227685123357e-09 ] [ -8.706931433399055e-09 3.030401881744164e-09 -1.01525555313568e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 2.736518 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.384385161998374e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.8108291 3.1466988 4.4550761 ] [ 5.5860378 1.8793746 1.3878849 ] [ 4.0884811 0.8289152 1.0332152 ] [ 2.603209 1.0827231 3.6885902 ] [ 4.9765511 2.7485338 4.2509799 ] [ 5.044563 4.9233717 0.3630747 ] [ 3.309734 5.0530032 -0.312534 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8108291e-10 3.1466988e-10 4.4550761e-10 ] [ 5.5860378e-10 1.8793746e-10 1.3878849e-10 ] [ 4.0884811e-10 8.289152e-11 1.0332152e-10 ] [ 2.603209e-10 1.0827231e-10 3.6885902e-10 ] [ 4.9765511e-10 2.7485338e-10 4.2509799e-10 ] [ 5.044563e-10 4.9233717e-10 3.630747e-11 ] [ 3.309734e-10 5.0530032e-10 -3.12534e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0001037 -9.56e-05 7.33e-05 ] [ -5.55e-05 -4.35e-05 -2.46e-05 ] [ 0.0001153 5.28e-05 -1.91e-05 ] [ 4.29e-05 0.0002047 -2.37e-05 ] [ -0.0001857 -9.48e-05 7.51e-05 ] [ 4.61e-05 3.23e-05 -7.14e-05 ] [ -6.68e-05 -5.59e-05 -9.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6614571557696e-13 -1.5316808494848e-13 1.1743954630464e-13 ] [ -8.892080245440001e-14 -6.969468300480001e-14 -3.941354487168e-14 ] [ 1.8473096437824e-13 8.459492557824e-14 -3.060157345728e-14 ] [ 6.873337703232e-14 3.2796555427776e-13 -3.797158591296e-14 ] [ -2.9752419848256e-13 -1.5188634365184e-13 1.2032346422208e-13 ] [ 7.386034221888001e-14 5.175030485184e-14 -1.1439541072512e-13 ] [ -1.0702539826944e-13 -8.956167310272e-14 -1.52206778976e-14 ] ] } "relaxed-potential-energy" { "source-value" -29.703366 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.759003856426561e-18 } }