{ "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" [ [ 0.7607129 0.1029019 2.480933 ] [ 0.9158836 2.552597 0.2381701 ] [ 0.8989231 2.268448 2.632769 ] [ 2.109562 0.2713555 0.0459784 ] [ 2.969591 1.985029 0.1686784 ] [ 2.973458 2.362165 2.304699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.607129000000001e-11 1.029019e-11 2.480933e-10 ] [ 9.158836e-11 2.552597e-10 2.381701e-11 ] [ 8.989231e-11 2.268448e-10 2.632769e-10 ] [ 2.109562e-10 2.713555e-11 4.59784e-12 ] [ 2.969591e-10 1.985029e-10 1.686784e-11 ] [ 2.973458e-10 2.362165e-10 2.304699e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.562339 -1.9194453 -3.5656508 ] [ -6.3846951 1.1036407 -2.2394246 ] [ -3.9023506 1.6252622 0.6249344 ] [ -7.2003 -10.0239552 2.6068549 ] [ 9.1276652 8.3258364 -1.7264278 ] [ 6.7973415 0.8886613 4.2997139 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.503143019564051e-09 -3.075290384564443e-09 -5.712802349696817e-09 ] [ -1.022940922015632e-08 1.768227327303347e-09 -3.587953738164391e-09 ] [ -6.252254897484853e-09 2.603957099509974e-09 1.001255285213676e-09 ] [ -1.153615232274624e-08 -1.606014666938659e-08 4.176641974597923e-09 ] [ 1.462413178592976e-08 1.333946042868564e-08 -2.766042258659178e-09 ] [ 1.08905416348936e-08 1.423792358669735e-09 6.88890108670879e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.830291 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.215856889906066e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7923841 -0.0060399 2.196474 ] [ 0.8923014 2.4019072 0.32944 ] [ 0.8609255 2.2622952 2.7022956 ] [ 1.707165 0.1515306 0.0627044 ] [ 3.2611042 1.9907649 0.1914474 ] [ 3.1142505 2.7420385 2.3888665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.923841e-11 -6.0399e-13 2.196474e-10 ] [ 8.923014e-11 2.4019072e-10 3.2944e-11 ] [ 8.609255000000001e-11 2.2622952e-10 2.7022956e-10 ] [ 1.707165e-10 1.515306e-11 6.270439999999999e-12 ] [ 3.2611042e-10 1.9907649e-10 1.914474e-11 ] [ 3.1142505e-10 2.7420385e-10 2.3888665e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.75e-05 0.0001387 -3.77e-05 ] [ -7.56e-05 -8.96e-05 2.71e-05 ] [ -3.18e-05 -5.45e-05 -1.74e-05 ] [ -7.9e-06 1.3e-05 -4.23e-05 ] [ 1.23e-05 -3.26e-05 4.02e-05 ] [ 7.55e-05 2.49e-05 3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.4059857072e-14 2.2222189730496e-13 -6.040205860416e-14 ] [ -1.2112455253248e-13 -1.4355502522368e-13 4.341898642368e-14 ] [ -5.094921654144e-14 -8.731862583360001e-14 -2.787787320192e-14 ] [ -1.265719530432e-14 2.08282960704e-14 -6.777207105984e-14 ] [ 1.970677243584e-14 -5.223095783807999e-14 6.440750015616e-14 ] [ 1.209643348704e-13 3.989419785791999e-14 4.8065298624e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.074191 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.895804626007377e-18 } }