{ "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" [ [ 0.148581 1.499098 2.912634 ] [ 0.4436014 1.560152 0.6683764 ] [ 2.110053 0.4783189 0.3653162 ] [ 2.063967 1.021193 2.434749 ] [ 2.249538 2.67297 1.348927 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.48581e-11 1.499098e-10 2.912634e-10 ] [ 4.436014e-11 1.560152e-10 6.683764e-11 ] [ 2.110053e-10 4.783189e-11 3.653162e-11 ] [ 2.063967e-10 1.021193e-10 2.434749e-10 ] [ 2.249538e-10 2.67297e-10 1.348927e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.09238 0.6696091 5.0732209 ] [ -10.453644 3.3070373 -2.3196045 ] [ 7.402252 -6.7417389 -6.4154083 ] [ 6.5379243 -9.1635453 9.2190619 ] [ 5.6058478 11.9286378 -5.5572699 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.45675986634295e-08 1.072832045094929e-09 8.128195918133934e-09 ] [ -1.67485840189662e-08 5.298457846173556e-09 -3.716416099402474e-09 ] [ 1.185971509567004e-08 -1.080145644911791e-08 -1.027861719114627e-08 ] [ 1.047490946202021e-08 -1.468161804330172e-08 1.477056544188803e-08 ] [ 8.981558284923115e-09 1.911178460115115e-08 -8.903727909255553e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.9970052 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.281261476785603e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0709448 1.2333921 2.9156953 ] [ 0.2066217 1.8483603 0.6672173 ] [ 2.168055 0.4233355 0.3690904 ] [ 2.2579946 0.9949716 2.7422662 ] [ 2.454014 2.7316724 1.0357334 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.09448e-12 1.2333921e-10 2.9156953e-10 ] [ 2.066217e-11 1.8483603e-10 6.672173000000001e-11 ] [ 2.168055e-10 4.233355e-11 3.690904e-11 ] [ 2.2579946e-10 9.949716e-11 2.7422662e-10 ] [ 2.454014e-10 2.7316724e-10 1.0357334e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-06 6e-07 1.4e-06 ] [ 1.71e-05 4.5e-06 2.58e-05 ] [ 1.7e-05 6.2e-06 1.66e-05 ] [ -1.86e-05 4e-06 -3.76e-05 ] [ -1.04e-05 -1.53e-05 -6.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883104e-15 9.6130597248e-16 2.24304726912e-15 ] [ 2.739722021568e-14 7.2097947936e-15 4.133615681664e-14 ] [ 2.72370025536e-14 9.93349504896e-15 2.659613190528e-14 ] [ -2.980048514688e-14 6.4087064832e-15 -6.024184094208e-14 ] [ -1.666263685632e-14 -2.451330229824e-14 -9.77327738688e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.226263 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.279298597995207e-18 } }