{ "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" [ [ -2.3307657 -15.814861 -13.1057608 ] [ -23.4107989 10.8696434 -5.3266756 ] [ -8.1680036 4.8685822 27.2184487 ] [ 23.1620769 -5.6611569 3.47954 ] [ 10.7474912 5.7377923 -12.2655523 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.734298313102546e-09 -2.533820055540171e-08 -2.099774355155711e-08 ] [ -3.750823467183036e-08 1.741508853191302e-08 -8.534275112905811e-09 ] [ -1.308658440653024e-08 7.800328577283029e-09 4.360876216158415e-08 ] [ 3.710973809835174e-08 -9.070173231860603e-09 5.574837639138433e-09 ] [ 1.721937913289374e-08 9.19295667806626e-09 -1.965158113625967e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.47978372 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.686982592244534e-20 } "relaxed-configuration-positions" { "source-value" [ [ 1.2712873 -0.1049814 1.1050277 ] [ 0.8909869 2.5078947 1.385319 ] [ 0.4279388 1.5741319 3.3235039 ] [ 2.9778967 1.0192987 1.9123998 ] [ 1.9544457 3.0118731 -0.4736835 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2712873e-10 -1.049814e-11 1.1050277e-10 ] [ 8.909869e-11 2.5078947e-10 1.385319e-10 ] [ 4.279388000000001e-11 1.5741319e-10 3.3235039e-10 ] [ 2.9778967e-10 1.0192987e-10 1.9123998e-10 ] [ 1.9544457e-10 3.0118731e-10 -4.736835e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0034368 0.0022641 0.0016259 ] [ 0.0046055 -0.0473746 0.0702574 ] [ -0.0112359 0.023942 -0.026605 ] [ -0.0034368 -0.0022641 -0.0016259 ] [ 0.0066304 0.0234325 -0.0436524 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.50636061036544e-12 3.62748808715328e-12 2.60497896775872e-12 ] [ 7.3788244270944e-12 -7.590247653975169e-11 1.125647637181939e-10 ] [ -1.800189629364672e-11 3.83593126551936e-11 -4.2625908996384e-11 ] [ -5.50636061036544e-12 -3.62748808715328e-12 -2.60497896775872e-12 ] [ 1.062307186655232e-11 3.7543003666896e-11 -6.993885472180992e-11 ] ] } "relaxed-potential-energy" { "source-value" -8.5353902 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.367520262784544e-18 } }