{ "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" [ [ 1.517632 2.497403 2.430037 ] [ 2.356059 3.814055 4.10925 ] [ 3.523853 1.378281 0.7370457 ] [ 5.112372 2.112569 2.363129 ] [ 3.211069 1.305526 3.310768 ] [ 3.335071 3.69898 1.575396 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.517632e-10 2.497403e-10 2.430037e-10 ] [ 2.356059e-10 3.814055e-10 4.109250000000001e-10 ] [ 3.523853e-10 1.378281e-10 7.370457e-11 ] [ 5.112372e-10 2.112569e-10 2.363129e-10 ] [ 3.211069e-10 1.305526e-10 3.310768e-10 ] [ 3.335071e-10 3.69898e-10 1.575396e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4088305 -0.0396137 -0.0672051 ] [ -0.6305919 2.2409089 2.806481 ] [ 0.706769 -2.4183955 -4.275751 ] [ 2.530322 0.1319292 0.522348 ] [ 0.0329106 -5.1149262 4.4280826 ] [ 0.7694208 5.2000973 -3.4139556 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.461548531369974e-09 -6.346814400338497e-11 -1.076744400185261e-10 ] [ -1.010319599445852e-09 3.590331848922645e-09 4.496478244919404e-09 ] [ 1.132368768106195e-09 -3.874696729947926e-09 -6.85050828856222e-09 ] [ 4.054022751495897e-09 2.113738798408474e-10 8.368937535216385e-10 ] [ 5.272859389650048e-11 -8.195015174757386e-09 7.094570416691278e-09 ] [ 1.232748017317233e-09 8.331474319945205e-09 -5.469759846769237e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.991545 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.921257304627114e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.606035 1.7792201 2.6920679 ] [ 1.88787 4.1204316 2.9451882 ] [ 2.8937756 1.43309 0.6353117 ] [ 4.8196403 2.1130462 1.9906932 ] [ 3.6349784 0.9989933 3.824764 ] [ 4.2137567 4.3620329 2.4376006 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.606035e-10 1.7792201e-10 2.6920679e-10 ] [ 1.88787e-10 4.1204316e-10 2.9451882e-10 ] [ 2.8937756e-10 1.43309e-10 6.353117e-11 ] [ 4.8196403e-10 2.1130462e-10 1.9906932e-10 ] [ 3.6349784e-10 9.989933e-11 3.824764e-10 ] [ 4.2137567e-10 4.3620329e-10 2.4376006e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.9e-06 2.2e-06 1.5e-05 ] [ 1.77e-05 -1.24e-05 2.8e-05 ] [ 7.4e-06 -1.36e-05 -7.87e-05 ] [ -4.8e-06 -4.5e-06 1.09e-05 ] [ -9.5e-06 2.2e-06 4.06e-05 ] [ -3e-06 2.61e-05 -1.59e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.265719530432e-14 3.52478856576e-15 2.4032649312e-14 ] [ 2.835852618816e-14 -1.986699009792e-14 4.48609453824e-14 ] [ 1.185610699392e-14 -2.178960204288e-14 -1.2609130005696e-13 ] [ -7.69044777984e-15 -7.2097947936e-15 1.746372516672e-14 ] [ -1.52206778976e-14 3.52478856576e-15 6.504837080448e-14 ] [ -4.8065298624e-15 4.181680980288e-14 -2.547460827072e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.186062 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.753510674001929e-18 } }