{ "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" [ [ 1.62041 2.509202 2.566624 ] [ 2.85955 3.94705 0.1409863 ] [ 3.121365 1.927989 0.779992 ] [ 4.065015 5.453159 1.199522 ] [ 3.840762 3.584521 2.337034 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.62041e-10 2.509202e-10 2.566624e-10 ] [ 2.85955e-10 3.94705e-10 1.409863e-11 ] [ 3.121365e-10 1.927989e-10 7.79992e-11 ] [ 4.065015e-10 5.453159000000001e-10 1.199522e-10 ] [ 3.840762e-10 3.584521e-10 2.337034e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8175184 0.0807971 -0.1858338 ] [ -0.9686962 2.0393306 -1.6739664 ] [ 0.122902 -2.671728 1.2676079 ] [ 0.8801145 2.0919743 -0.0924238 ] [ -0.8518387 -1.5403741 0.6846161 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.309808867553823e-09 1.294512246484397e-10 -2.97738569714423e-10 ] [ -1.552022404297801e-09 3.267367809402037e-09 -2.681989830084741e-09 ] [ 1.969107110495616e-10 -4.280580138736742e-09 2.030931741721384e-09 ] [ 1.410098875527082e-09 3.351712314774445e-09 -1.480792515654951e-10 ] [ -1.364796049832665e-09 -2.467951370305841e-09 1.096875909643275e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.29370039923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.879266396373864e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.9109379 2.0486357 2.8710469 ] [ 2.9970329 4.1612124 -0.0779455 ] [ 2.9706366 1.9578882 0.8388843 ] [ 4.4341149 5.4338891 1.1774231 ] [ 3.1943796 3.8202955 2.2147495 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9109379e-10 2.0486357e-10 2.8710469e-10 ] [ 2.9970329e-10 4.161212400000001e-10 -7.794550000000001e-12 ] [ 2.9706366e-10 1.9578882e-10 8.388843e-11 ] [ 4.4341149e-10 5.4338891e-10 1.1774231e-10 ] [ 3.1943796e-10 3.8202955e-10 2.2147495e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.4e-06 7.37e-05 -7.05e-05 ] [ -3.68e-05 -4.9e-06 2.14e-05 ] [ 2.84e-05 -4.2e-06 1.98e-05 ] [ 1.09e-05 2.41e-05 -3.41e-05 ] [ -1.09e-05 -8.87e-05 6.33e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.345828361472e-14 1.1808041695296e-13 -1.129534517664e-13 ] [ -5.896009964544001e-14 -7.850665441919999e-15 3.428657968511999e-14 ] [ 4.550181603071999e-14 -6.72914180736e-15 3.172309709184e-14 ] [ 1.746372516672e-14 3.861245656128e-14 -5.463422276928e-14 ] [ -1.746372516672e-14 -1.4211306626496e-13 1.0141778009664e-13 ] ] } "relaxed-potential-energy" { "source-value" -4.99599539923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.004467026278599e-19 } }