{ "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" [ [ 2.301375 1.527111 2.019819 ] [ 1.794175 5.106546 1.47688 ] [ 0.9503771 3.237781 1.232452 ] [ 3.392468 3.669062 0.7528338 ] [ 3.101246 3.595776 2.776891 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.301375e-10 1.527111e-10 2.019819e-10 ] [ 1.794175e-10 5.106546e-10 1.47688e-10 ] [ 9.503771e-11 3.237781e-10 1.232452e-10 ] [ 3.392468e-10 3.669062e-10 7.528338e-11 ] [ 3.101246e-10 3.595776e-10 2.776891e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3274386 4.7008888 -1.1130113 ] [ 1.7048444 1.5437179 2.171548 ] [ 6.558792 -2.7815627 2.0524041 ] [ -3.0671296 -3.0198552 -0.0798888 ] [ -5.5239454 -0.4431888 -3.0310519 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.246144739896724e-10 7.5316541943923e-09 -1.783240698237964e-09 ] [ 2.731461862285749e-09 2.473308748867548e-09 3.479203465209432e-09 ] [ 1.050834328966613e-08 -4.456554763945952e-09 3.288313892545799e-09 ] [ -4.914083378569766e-09 -4.838341439503396e-09 -1.279959686782992e-10 ] [ -8.850336247371781e-09 -7.100667398104991e-10 -4.856280530621305e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.38701304636885 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.664182959994533e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5778525 1.6702139 1.841949 ] [ 2.0271468 5.1838495 1.4735744 ] [ 0.9344706 3.1801169 1.3477757 ] [ 3.2634489 3.466482 0.5974708 ] [ 2.7367224 3.6356137 2.9981059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5778525e-10 1.6702139e-10 1.841949e-10 ] [ 2.0271468e-10 5.1838495e-10 1.4735744e-10 ] [ 9.344706000000001e-11 3.1801169e-10 1.3477757e-10 ] [ 3.263448900000001e-10 3.466482e-10 5.974708e-11 ] [ 2.7367224e-10 3.6356137e-10 2.9981059e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.4e-05 7.92e-05 -1.59e-05 ] [ 4.45e-05 -2.54e-05 -1.91e-05 ] [ 0.000171 1.01e-05 8.29e-05 ] [ -0.0001299 -3.3e-06 0.0001497 ] [ -9.96e-05 -6.05e-05 -0.0001975 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.243047287599999e-14 1.268923894128e-13 -2.54746084806e-14 ] [ 7.129686021299999e-14 -4.06952865036e-14 -3.06015737094e-14 ] [ 2.73972204414e-13 1.61819840034e-14 1.328204429586e-13 ] [ -2.081227447566e-13 -5.2871828922e-15 2.398458421098e-13 ] [ -1.595767927464e-13 -9.693168635699998e-14 -3.16429885215e-13 ] ] } "relaxed-potential-energy" { "source-value" -12.92419804636885 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.070684812308062e-18 } }