{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.096068 2.7039 2.040826 ] [ 2.700744 4.841018 2.002574 ] [ 4.164753 1.488214 0.9121723 ] [ 3.472077 2.802445 4.029704 ] [ 4.572692 3.360808 2.141211 ] [ 3.154153 3.397307 0.264031 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.096068e-10 2.7039e-10 2.040826e-10 ] [ 2.700744e-10 4.841018000000001e-10 2.002574e-10 ] [ 4.164753e-10 1.488214e-10 9.121723000000001e-11 ] [ 3.472077e-10 2.802445e-10 4.029704e-10 ] [ 4.572692e-10 3.360808e-10 2.141211e-10 ] [ 3.154153e-10 3.397307e-10 2.64031e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -40.9684959 -15.1880939 10.265937 ] [ -10.0892747 30.6440857 1.016791 ] [ 11.3445335 -19.6807083 -7.5550673 ] [ 2.704164 -7.1750303 16.457765 ] [ 41.6975774 6.3783929 13.5368493 ] [ -4.6885044 5.0213539 -33.722275 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.563876632032066e-08 -2.433400896109509e-08 1.644784425200569e-08 ] [ -1.616480004516894e-08 4.909723767433161e-08 1.629078768439853e-09 ] [ 1.81759463475824e-08 -3.153197071904451e-08 -1.210455219663058e-08 ] [ 4.332548339609012e-09 -1.149566580019161e-08 2.636824631362051e-08 ] [ 6.680688365427846e-08 1.021931198265671e-08 2.168842346775285e-08 ] [ -7.511812136197933e-09 8.045095823342902e-09 -5.402904060518832e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 23.250409 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.725126172383791e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3829884 3.3232272 3.1678245 ] [ 2.7387001 4.5248438 1.5645052 ] [ 4.9275623 2.0548102 0.4759659 ] [ 3.3074714 2.1920208 4.0767856 ] [ 4.8007171 3.312827 2.5384358 ] [ 3.0030477 3.1859629 -0.4329986 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3829884e-10 3.3232272e-10 3.1678245e-10 ] [ 2.7387001e-10 4.5248438e-10 1.5645052e-10 ] [ 4.9275623e-10 2.0548102e-10 4.759659e-11 ] [ 3.3074714e-10 2.1920208e-10 4.0767856e-10 ] [ 4.8007171e-10 3.312827e-10 2.5384358e-10 ] [ 3.0030477e-10 3.1859629e-10 -4.329986e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.3e-06 -2.57e-05 1.2e-06 ] [ -1.71e-05 4.4e-06 -2.72e-05 ] [ -2.81e-05 -2.02e-05 5e-07 ] [ 2.17e-05 3.17e-05 -3.54e-05 ] [ 3.8e-06 -1.36e-05 1.35e-05 ] [ 2.8e-05 2.35e-05 4.74e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.329806595264e-14 -4.117593915456e-14 1.92261194496e-15 ] [ -2.739722021568e-14 7.04957713152e-15 -4.357920408576e-14 ] [ -4.502116304448e-14 -3.236396774016e-14 8.010883104e-16 ] [ 3.476723267136e-14 5.078899887936e-14 -5.671705237632e-14 ] [ 6.08827115904e-15 -2.178960204288e-14 2.16293843808e-14 ] [ 4.48609453824e-14 3.76511505888e-14 7.594317182591999e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.987622 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.241064094898774e-18 } }