{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.992263 2.655886 1.517325 ] [ 2.686183 2.997874 4.828117 ] [ 1.135569 3.58045 3.551064 ] [ 3.228076 1.641916 3.257925 ] [ 4.134079 3.318369 1.708542 ] [ 3.231459 4.785804 3.060879 ] [ 4.593203 3.196107 3.900565 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992263e-10 2.655886e-10 1.517325e-10 ] [ 2.686183e-10 2.997874e-10 4.828117e-10 ] [ 1.135569e-10 3.58045e-10 3.551064e-10 ] [ 3.228076e-10 1.641916e-10 3.257925e-10 ] [ 4.134079e-10 3.318369e-10 1.708542e-10 ] [ 3.231459e-10 4.785804e-10 3.060879e-10 ] [ 4.593203e-10 3.196107e-10 3.900565e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5367351 -0.9023235 -0.9215343 ] [ -2.0187164 0.2245032 8.6827663 ] [ -3.7368711 2.1469555 -3.0684631 ] [ -0.9306714 -8.3983047 -3.5586973 ] [ 2.6593857 -0.9274433 -4.9197679 ] [ -2.3274766 5.8601329 1.0008492 ] [ 8.8910848 1.9964799 2.7848472 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.06429767038275e-09 -1.445681616098429e-09 -1.476460710725294e-09 ] [ -3.234340220105542e-09 3.596937783347866e-10 1.391132516973012e-08 ] [ -5.987127511363179e-09 3.439801907997974e-09 -4.916219840607494e-09 ] [ -1.491099958727205e-09 -1.345556744469476e-08 -5.701661614564084e-09 ] [ 4.260805594229843e-09 -1.485927972377601e-09 -7.882337109142312e-09 ] [ -3.729028593979073e-09 9.388967927160904e-09 1.603537189186383e-09 ] [ 1.424508820011024e-08 3.198713419677122e-09 4.461817076340342e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.209113 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.757203851330535e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0958392 2.3768595 1.72711 ] [ 2.4849554 2.6867173 5.030595 ] [ 1.3341421 3.8995055 3.3769144 ] [ 3.2480385 1.161358 3.3778291 ] [ 4.0440147 3.6616741 1.437724 ] [ 3.2809455 5.1870592 3.0904742 ] [ 4.5128967 3.2032324 3.7837702 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0958392e-10 2.3768595e-10 1.72711e-10 ] [ 2.4849554e-10 2.6867173e-10 5.030595e-10 ] [ 1.3341421e-10 3.8995055e-10 3.3769144e-10 ] [ 3.2480385e-10 1.161358e-10 3.3778291e-10 ] [ 4.0440147e-10 3.6616741e-10 1.437724e-10 ] [ 3.2809455e-10 5.187059200000001e-10 3.0904742e-10 ] [ 4.5128967e-10 3.2032324e-10 3.783770200000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.79e-05 1.36e-05 2.61e-05 ] [ -3.49e-05 1.3e-05 6.3e-06 ] [ 2.42e-05 -8.9e-06 3.5e-06 ] [ -4.02e-05 -4.55e-05 1.5e-06 ] [ -1.5e-06 1.86e-05 2.26e-05 ] [ -1.35e-05 -3.27e-05 2.2e-06 ] [ 2.81e-05 4.19e-05 -6.22e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.072249392832e-14 2.178960204288e-14 4.181680980288e-14 ] [ -5.591596406592e-14 2.08282960704e-14 1.009371271104e-14 ] [ 3.877267422336e-14 -1.425937192512e-14 5.6076181728e-15 ] [ -6.440750015616e-14 -7.28990362464e-14 2.4032649312e-15 ] [ -2.4032649312e-15 2.980048514688e-14 3.620919163008e-14 ] [ -2.16293843808e-14 -5.239117550016001e-14 3.52478856576e-15 ] [ 4.502116304448e-14 6.713120041152e-14 -9.965538581376e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.906032 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.669950894569667e-18 } }