{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.101107 2.382088 1.155059 ] [ 1.870329 4.675053 0.5879216 ] [ 2.558831 4.133121 3.113399 ] [ 4.446179 2.802067 2.809564 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.101107e-10 2.382088e-10 1.155059e-10 ] [ 1.870329e-10 4.675053e-10 5.879216e-11 ] [ 2.558831e-10 4.133121e-10 3.113399e-10 ] [ 4.446179e-10 2.802067e-10 2.809564e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1554319 1.2079484 1.194154 ] [ 0.3426238 -0.745441 1.3642991 ] [ -0.0701173 -0.5169816 -1.9182722 ] [ -1.4279384 0.0544742 -0.6401808 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.851205977106524e-09 1.935346685612767e-09 1.913245620434803e-09 ] [ 5.48943842089655e-10 -1.194328142385773e-09 2.185848121798481e-09 ] [ -1.123402987736198e-10 -8.282958329037774e-10 -3.073410871170582e-09 ] [ -2.287809520422559e-09 8.727728967678336e-11 -1.025682710845041e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.1777872 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.295729599317494e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.6511197 2.3211403 0.833824 ] [ 1.6939282 4.3608918 1.0687438 ] [ 2.8371054 4.6750256 2.9991467 ] [ 3.7942927 2.6352714 2.7642291 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6511197e-10 2.3211403e-10 8.33824e-11 ] [ 1.6939282e-10 4.3608918e-10 1.0687438e-10 ] [ 2.8371054e-10 4.6750256e-10 2.9991467e-10 ] [ 3.7942927e-10 2.6352714e-10 2.7642291e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.8e-06 6e-06 2.8e-06 ] [ 3.9e-06 -2e-06 2.1e-06 ] [ -3e-07 -1.01e-05 -6.5e-06 ] [ -9e-07 6.1e-06 1.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.48609453824e-15 9.6130597248e-15 4.48609453824e-15 ] [ 6.24848882112e-15 -3.2043532416e-15 3.36457090368e-15 ] [ -4.8065298624e-16 -1.618198387008e-14 -1.04141480352e-14 ] [ -1.44195895872e-15 9.77327738688e-15 2.56348259328e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.4872904 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.039378501122028e-18 } }