{ "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" [ [ 3.034718 3.53714 2.04977 ] [ 2.090115 3.249613 4.258758 ] [ 4.260617 1.92046 3.281861 ] [ 5.152468 4.155846 3.194292 ] [ 3.505339 5.178097 3.977293 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.034718e-10 3.53714e-10 2.04977e-10 ] [ 2.090115e-10 3.249613e-10 4.258758e-10 ] [ 4.260617e-10 1.92046e-10 3.281861e-10 ] [ 5.152468e-10 4.155846e-10 3.194292e-10 ] [ 3.505339e-10 5.178097e-10 3.977293e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1707802 0.1018199 0.6136855 ] [ 0.6159604 -0.1707079 -0.4799137 ] [ -0.5356714 0.5205299 0.1739879 ] [ 2.2714756 -1.5978857 -1.2650116 ] [ -2.5225447 1.1462438 0.957252 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.736200437355481e-10 1.631334633121939e-10 9.832325606239584e-10 ] [ 9.868773522186163e-10 -2.735042063658643e-10 -7.68906510141625e-10 ] [ -8.582401935112051e-10 8.33980836207362e-10 2.787593456820883e-10 ] [ 3.639305101037653e-09 -2.560095111250643e-09 -2.026772010560802e-09 ] [ -4.04156214326295e-09 1.836485018096951e-09 1.533686774614042e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.788897 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.049007177921926e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1060785 3.7002772 2.1028458 ] [ 2.2093483 3.116332 4.2435641 ] [ 4.1288416 1.9582432 3.3862478 ] [ 5.2592334 4.0541124 3.0859837 ] [ 3.3397552 5.2121911 3.9433326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1060785e-10 3.7002772e-10 2.1028458e-10 ] [ 2.2093483e-10 3.116332e-10 4.243564100000001e-10 ] [ 4.1288416e-10 1.9582432e-10 3.3862478e-10 ] [ 5.259233400000001e-10 4.0541124e-10 3.0859837e-10 ] [ 3.3397552e-10 5.212191100000001e-10 3.9433326e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.6e-06 1.85e-05 -2.62e-05 ] [ 2.9e-06 -2.42e-05 3.06e-05 ] [ -1.8e-06 2.4e-06 -3e-06 ] [ -3.3e-06 -1.62e-05 1.22e-05 ] [ -4.4e-06 1.95e-05 -1.35e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.057436569728e-14 2.96402674848e-14 -4.197702746496e-14 ] [ 4.646312200320001e-15 -3.877267422336e-14 4.902660459647999e-14 ] [ -2.88391791744e-15 3.84522388992e-15 -4.8065298624e-15 ] [ -5.28718284864e-15 -2.595526125696e-14 1.954655477376e-14 ] [ -7.04957713152e-15 3.12424441056e-14 -2.16293843808e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.137319633913408e-18 } }