{ "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" [ [ 1.178267 0.166744 1.149708 ] [ 0.7840536 2.31607 1.236295 ] [ 0.8079908 1.595267 2.952936 ] [ 2.817536 1.157767 1.902801 ] [ 1.934708 2.772369 0.0108268 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.178267e-10 1.66744e-11 1.149708e-10 ] [ 7.840536e-11 2.31607e-10 1.236295e-10 ] [ 8.079908000000001e-11 1.595267e-10 2.952936e-10 ] [ 2.817536e-10 1.157767e-10 1.902801e-10 ] [ 1.934708e-10 2.772369e-10 1.08268e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -96.2845529 -94.0987571 46.1232601 ] [ -584.5386659 44.1937016 263.7426148 ] [ 102.1511979 -177.3381907 91.6011788 ] [ 89.0036865 37.9682871 95.7346084 ] [ 489.6683344 189.2749591 -497.2016622 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.542648596005608e-07 -1.50762828671958e-07 7.389760900729748e-08 ] [ -9.365341844586021e-07 7.080611549013155e-08 4.225622513412201e-07 ] [ 1.63664261062094e-07 -2.84127103114512e-07 1.467612671110806e-07 ] [ 1.425996256753126e-07 6.083190192344222e-08 1.533837513799233e-07 ] [ 7.845351573217564e-07 3.032519143728962e-07 -7.96604878999739e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 349.66421 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.602238223925016e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.8955426 -0.3022825 0.9614099 ] [ -0.2611314 2.4127803 0.879419 ] [ 1.0571888 1.8012358 3.4492821 ] [ 3.3974464 0.995902 1.839691 ] [ 2.4335091 3.1005814 0.1227648 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.955426e-11 -3.022825e-11 9.614099e-11 ] [ -2.611314e-11 2.4127803e-10 8.79419e-11 ] [ 1.0571888e-10 1.8012358e-10 3.4492821e-10 ] [ 3.3974464e-10 9.95902e-11 1.839691e-10 ] [ 2.4335091e-10 3.1005814e-10 1.227648e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 1.31e-05 1.84e-05 ] [ 4.8e-06 -6.7e-06 -7.3e-06 ] [ -2.4e-06 -1e-05 -4.3e-06 ] [ -5.6e-06 1e-07 -1.18e-05 ] [ 3.3e-06 3.5e-06 5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 2.098851373248e-14 2.948004982272e-14 ] [ 7.69044777984e-15 -1.073458335936e-14 -1.169588933184e-14 ] [ -3.84522388992e-15 -1.6021766208e-14 -6.889359469440001e-15 ] [ -8.972189076479999e-15 1.6021766208e-16 -1.890568412544e-14 ] [ 5.28718284864e-15 5.6076181728e-15 8.010883104e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.133456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.943993953270549e-18 } }