{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -4.02425e-11 1.3992865e-10 3.4987941e-10 ] [ 1.4597355e-10 6.6626593e-10 2.2617076e-10 ] [ 1.5339946e-10 2.6759885e-10 -1.5293452e-10 ] [ 6.395671e-10 3.4039568e-10 9.674834e-11 ] [ 4.4739889e-10 -1.1423042e-10 3.394382e-10 ] [ 4.112323e-10 3.7053141e-10 6.0653745e-10 ] ] "source-value" [ [ -0.402425 1.3992865 3.4987941 ] [ 1.4597355 6.6626593 2.2617076 ] [ 1.5339946 2.6759885 -1.5293452 ] [ 6.395671 3.4039568 0.9674834 ] [ 4.4739889 -1.1423042 3.394382 ] [ 4.112323 3.7053141 6.0653745 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.6021766208e-16 1.6021766208e-16 0.0 ] [ -3.2043532416e-16 3.2043532416e-16 -3.2043532416e-16 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 1.6021766208e-16 -1.6021766208e-16 0.0 ] [ 3.2043532416e-16 -3.2043532416e-16 3.2043532416e-16 ] ] "source-value" [ [ -1e-07 1e-07 0.0 ] [ -2e-07 2e-07 -2e-07 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 1e-07 -1e-07 -0.0 ] [ 2e-07 -2e-07 2e-07 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.864154448120505e-32 "source-value" 1.1635137e-13 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.631022733252213e-08 -1.342415500964969e-08 6.169154001605509e-09 ] [ -1.075520177029308e-08 2.93001982872404e-08 1.154812058210362e-09 ] [ -9.164507949334349e-09 -1.586861094046449e-09 -2.849501561448595e-08 ] [ 2.744279845553553e-08 2.519528640082635e-09 -1.469362299250371e-08 ] [ 9.872458047761018e-09 -2.749181320402502e-08 6.256589105679441e-09 ] [ 8.914680548853004e-09 1.068310238039812e-08 2.960808360171202e-08 ] ] "source-value" [ [ -16.4215524 -8.3786986 3.8504831 ] [ -6.712869 18.2877455 0.720777 ] [ -5.720036 -0.9904408 -17.78519 ] [ 17.1284477 1.5725661 -9.1710382 ] [ 6.1619037 -17.1590403 3.9050558 ] [ 5.564106 6.6678681 18.4799124 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.164346819563703e-17 "source-value" 72.672813 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.601719e-10 2.058557e-10 2.955044e-10 ] [ 2.276438e-10 4.437644e-10 2.326663e-10 ] [ 2.333208e-10 3.134057e-10 6.738404e-11 ] [ 4.271171e-10 2.797064000000001e-10 1.854938e-10 ] [ 3.738974e-10 1.035595e-10 3.022286e-10 ] [ 3.351778e-10 3.241984e-10 3.825625e-10 ] ] "source-value" [ [ 1.601719 2.058557 2.955044 ] [ 2.276438 4.437644 2.326663 ] [ 2.333208 3.134057 0.6738404 ] [ 4.271171 2.797064 1.854938 ] [ 3.738974 1.035595 3.022286 ] [ 3.351778 3.241984 3.825625 ] ] } "instance-id" 1 }