{ "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" [ [ 2.91343 2.805447 1.311156 ] [ 2.653002 2.505168 3.277079 ] [ 1.829519 4.618852 2.376516 ] [ 4.982305 1.900488 2.423676 ] [ 4.143762 3.996307 2.985709 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.91343e-10 2.805447e-10 1.311156e-10 ] [ 2.653002e-10 2.505168e-10 3.277079e-10 ] [ 1.829519e-10 4.618852000000001e-10 2.376516e-10 ] [ 4.982305e-10 1.900488e-10 2.423676e-10 ] [ 4.143762e-10 3.996307e-10 2.985709e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.659665 0.6443888 -8.0367451 ] [ -4.3136078 -4.4847609 8.1741682 ] [ 0.5604126 -0.2991001 0.0392464 ] [ -0.4212385 0.3497274 -0.0923808 ] [ 3.5147687 3.7897448 -0.0842887 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.056899840560032e-09 1.032424670065367e-09 -1.287628510654896e-08 ] [ -6.911161568460521e-09 -7.185379063857967e-09 1.309646118452682e-08 ] [ 8.978799657217421e-10 -4.79211187498942e-10 6.287966453056512e-11 ] [ -6.748984764808609e-10 5.6032506393317e-10 -1.480103579708006e-10 ] [ 5.631280238659609e-09 6.071840517358371e-09 -1.35045384537625e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -2.6711453992349483 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.279646709411716e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.6948466 2.4829501 1.0441475 ] [ 2.6538114 2.4496116 3.4094001 ] [ 2.2316523 4.4598056 2.2354851 ] [ 4.7024452 2.2285173 2.2468872 ] [ 4.2392625 4.2053775 3.4382162 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6948466e-10 2.4829501e-10 1.0441475e-10 ] [ 2.6538114e-10 2.4496116e-10 3.4094001e-10 ] [ 2.2316523e-10 4.4598056e-10 2.2354851e-10 ] [ 4.7024452e-10 2.2285173e-10 2.2468872e-10 ] [ 4.2392625e-10 4.2053775e-10 3.4382162e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.29e-05 -1e-07 -5.6e-06 ] [ 1.76e-05 -3.69e-05 -3.8e-06 ] [ 8.6e-06 2.34e-05 -1.72e-05 ] [ 1.05e-05 -1e-05 1.35e-05 ] [ -3.8e-06 2.37e-05 1.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.271161082432e-14 -1.6021766208e-16 -8.972189076479999e-15 ] [ 2.819830852608e-14 -5.912031730752001e-14 -6.08827115904e-15 ] [ 1.377871893888e-14 3.749093292672001e-14 -2.755743787776e-14 ] [ 1.68228545184e-14 -1.6021766208e-14 2.16293843808e-14 ] [ -6.08827115904e-15 3.797158591296e-14 2.098851373248e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.34072039923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.55677736188388e-19 } }