{ "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" [ [ 0.9192407 0.3679632 0.2084149 ] [ 0.7009294 0.9640354 2.373703 ] [ 0.5234459 2.737555 0.0024849 ] [ 2.754814 0.6958427 0.7664459 ] [ 2.641472 1.152124 2.712512 ] [ 2.849889 2.552424 1.475764 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.192407e-11 3.679632e-11 2.084149e-11 ] [ 7.009294e-11 9.640354e-11 2.373703e-10 ] [ 5.234459e-11 2.737555e-10 2.4849e-13 ] [ 2.754814e-10 6.958427e-11 7.664459e-11 ] [ 2.641472e-10 1.152124e-10 2.712512e-10 ] [ 2.849889e-10 2.552424e-10 1.475764e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.5676063 -1.9668073 -2.9297826 ] [ -3.482214 -1.4411922 8.2283967 ] [ -0.7221551 2.4159035 -0.290009 ] [ -0.7177005 -14.0266074 -18.1662284 ] [ -3.1009641 7.2594202 7.4533067 ] [ 3.4554274 7.7592832 5.7043165 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.318112026878791e-09 -3.151172673678772e-09 -4.694029185746638e-09 ] [ -5.579121859422451e-09 -2.309044448919317e-09 1.318334481940787e-08 ] [ -1.157020017811486e-09 3.870704105808893e-09 -4.646456396215872e-10 ] [ -1.149882961836471e-09 -2.247310244542027e-08 -2.910550643059299e-08 ] [ -4.968292182960114e-09 1.163087332500326e-08 1.1941513742392e-08 ] [ 5.53620499515173e-09 1.243174213720621e-08 9.139322533943684e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.8284265 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.735992053551172e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9474282 0.3126518 0.1252654 ] [ 0.3664311 0.7410017 2.4813599 ] [ 0.7193388 2.8049839 0.2622867 ] [ 2.8072984 0.3740874 0.4486334 ] [ 2.6446208 1.5138119 2.8193843 ] [ 2.9046738 2.7234076 1.402395 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.474282000000001e-11 3.126518e-11 1.252654e-11 ] [ 3.664311e-11 7.410017e-11 2.4813599e-10 ] [ 7.193388e-11 2.8049839e-10 2.622867e-11 ] [ 2.8072984e-10 3.740874e-11 4.486334e-11 ] [ 2.6446208e-10 1.5138119e-10 2.8193843e-10 ] [ 2.9046738e-10 2.7234076e-10 1.402395e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.4e-05 -3.7e-05 -4.87e-05 ] [ 1.6e-06 3.48e-05 -4.7e-06 ] [ -1.91e-05 -3.88e-05 5.17e-05 ] [ 9.34e-05 5.81e-05 2.5e-06 ] [ -3.36e-05 7.84e-05 -4.95e-05 ] [ 5.16e-05 -9.56e-05 4.86e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.506046023552e-13 -5.92805349696e-14 -7.802600143296e-14 ] [ 2.56348259328e-15 5.575574640383999e-14 -7.53023011776e-15 ] [ -3.060157345728e-14 -6.216445288704e-14 8.283253129536002e-14 ] [ 1.4964329638272e-13 9.308646166848001e-14 4.005441552e-15 ] [ -5.383313445888e-14 1.2561064707072e-13 -7.930774272959999e-14 ] [ 8.267231363328e-14 -1.5316808494848e-13 7.786578377088e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.293974 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.290147096112306e-18 } }