{ "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" [ [ 0.4008083 0.5190667 2.588988 ] [ 0.3705603 2.591564 0.7446841 ] [ 2.694344 0.0700188 2.876141 ] [ 2.159519 1.331763 1.766469 ] [ 2.561241 2.816208 0.1583109 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.008083e-11 5.190667e-11 2.588988e-10 ] [ 3.705603e-11 2.591564e-10 7.446841e-11 ] [ 2.694344e-10 7.001880000000001e-12 2.876141e-10 ] [ 2.159519e-10 1.331763e-10 1.766469e-10 ] [ 2.561241e-10 2.816208e-10 1.583109e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5214386 -0.0992109 0.1558588 ] [ -1.1271653 -0.5476135 0.6242651 ] [ 2.7040611 -5.753799 4.9244697 ] [ 0.1529373 5.6151168 -4.615654 ] [ 0.7916054 0.7855067 -1.0889396 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.039790008985672e-09 -1.589533858181106e-10 2.497133275632792e-10 ] [ -1.8059179063156e-09 -8.773735541629589e-10 1.000182956641673e-09 ] [ 4.332383511328337e-09 -9.218602314532564e-09 7.88987028818099e-09 ] [ 2.450325685270482e-10 8.99640893414085e-09 -7.395092989428636e-09 ] [ 1.268291675228223e-09 1.258520480590448e-09 -1.744673582957306e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.218137332689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.156473097543848e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2902408 0.6784056 2.472434 ] [ 0.2709439 2.3866829 0.9585032 ] [ 2.4492848 0.0761809 1.9406303 ] [ 2.795507 2.3763192 2.5357186 ] [ 2.3804961 1.8110318 0.2273069 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.902408e-11 6.784056000000001e-11 2.472434e-10 ] [ 2.709439e-11 2.3866829e-10 9.585032e-11 ] [ 2.4492848e-10 7.61809e-12 1.9406303e-10 ] [ 2.795507e-10 2.3763192e-10 2.5357186e-10 ] [ 2.3804961e-10 1.8110318e-10 2.273069e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0047717 0.000783 -0.0039283 ] [ -0.0038691 0.0003608 0.0002917 ] [ 0.0034208 -0.0043054 -0.0057344 ] [ 0.0080933 0.0108717 0.0091566 ] [ -0.0028733 -0.0077102 0.0002144 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.6451062444578e-12 1.254504304422e-12 -6.2938304713422e-12 ] [ -6.198981614609399e-12 5.780653295471999e-13 4.673549241378e-13 ] [ 5.480725829587199e-12 -6.898011280023599e-12 -9.187521690009599e-12 ] [ 1.29668961519522e-11 1.74183837118578e-11 1.46704905668844e-11 ] [ -4.6035341224722e-12 -1.23531022834668e-11 3.435066703295999e-13 ] ] } "relaxed-potential-energy" { "source-value" -12.030650432689672 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.927522701507738e-18 } }