{ "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" [ [ 1.097689 0.3905239 0.41263 ] [ 0.032965 0.0756626 2.808384 ] [ 2.827906 0.6568563 1.349893 ] [ 2.515385 2.187975 0.7174512 ] [ 1.727021 2.867394 2.060494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.097689e-10 3.905239e-11 4.1263e-11 ] [ 3.2965e-12 7.56626e-12 2.808384e-10 ] [ 2.827906e-10 6.568562999999999e-11 1.349893e-10 ] [ 2.515385e-10 2.187975e-10 7.174512e-11 ] [ 1.727021e-10 2.867394e-10 2.060494e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.6871383 -7.7990694 -4.4201698 ] [ 0.4278058 0.3320637 -1.1768232 ] [ 10.6437954 -17.6215263 7.6205178 ] [ 6.5535358 12.5220849 -16.8029045 ] [ -7.9379988 12.5664472 14.7793796 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.552050650671626e-08 -1.249548665667668e-08 -7.081892713526213e-09 ] [ 6.854204510026408e-10 5.320246967563451e-10 -1.885478617855043e-09 ] [ 1.705324014645859e-08 -2.823279746067233e-08 1.220941545755025e-08 ] [ 1.049992184233582e-08 2.00625916704527e-08 -2.692122075143512e-08 ] [ -1.271807609329845e-08 2.013366791035762e-08 2.367917646504846e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 6.4780582 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.037899339622173e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0406032 -0.6176511 1.0912889 ] [ -0.1063019 0.9601981 2.3706 ] [ 3.0164577 0.3655136 0.3356179 ] [ 3.0899959 2.5514762 1.1466684 ] [ 1.1602112 2.918875 2.404677 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0406032e-10 -6.176511e-11 1.0912889e-10 ] [ -1.063019e-11 9.601981000000001e-11 2.3706e-10 ] [ 3.0164577e-10 3.655136e-11 3.356179e-11 ] [ 3.0899959e-10 2.5514762e-10 1.1466684e-10 ] [ 1.1602112e-10 2.918875e-10 2.404677e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.82e-05 -3.22e-05 9.3e-06 ] [ -2.17e-05 -7.3e-06 -7.6e-06 ] [ -3.7e-06 -5.7e-06 -3.52e-05 ] [ 1.8e-05 -1.13e-05 9.6e-06 ] [ -1.09e-05 5.64e-05 2.39e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.915961449856e-14 -5.159008718975999e-14 1.490024257344e-14 ] [ -3.476723267136e-14 -1.169588933184e-14 -1.217654231808e-14 ] [ -5.928053496960001e-15 -9.13240673856e-15 -5.639661705216e-14 ] [ 2.88391791744e-14 -1.810459581504e-14 1.538089555968e-14 ] [ -1.746372516672e-14 9.036276141312001e-14 3.829202123712e-14 ] ] } "relaxed-potential-energy" { "source-value" -7.4797183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.198382979042992e-18 } }