{ "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" [ [ 0.9900206 -0.3625598 1.1497566 ] [ -0.0527864 0.7983904 0.47367 ] [ -0.7728366 0.1785777 -1.1449021 ] [ -0.1643975 -0.6144083 -0.4785245 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.586187859430389e-09 -5.808848352019238e-10 1.842113144130497e-09 ] [ -8.457313597619711e-11 1.27916243315116e-09 7.58902999974336e-10 ] [ -1.238220732218561e-09 2.861130159362362e-10 -1.834335377724824e-09 ] [ -2.63393831017968e-10 -9.843906138854727e-10 -7.666807663800096e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.5889313 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.055663168491735e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6538917 2.2590728 0.7809855 ] [ 1.6472277 4.4029984 1.0162297 ] [ 2.8343036 4.7370758 3.0520051 ] [ 3.8410229 2.5931819 2.8167233 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6538917e-10 2.2590728e-10 7.809855e-11 ] [ 1.6472277e-10 4.402998400000001e-10 1.0162297e-10 ] [ 2.8343036e-10 4.737075800000001e-10 3.0520051e-10 ] [ 3.8410229e-10 2.5931819e-10 2.8167233e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.38e-05 4.88e-05 3.12e-05 ] [ -9.4e-06 -1.27e-05 3.43e-05 ] [ 5.7e-06 -1.39e-05 -6.14e-05 ] [ -3e-05 -2.22e-05 -4.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.415356978304e-14 7.818621909504e-14 4.998791056896e-14 ] [ -1.506046023552e-14 -2.034764308416e-14 5.495465809344e-14 ] [ 9.13240673856e-15 -2.227025502912e-14 -9.837364451712e-14 ] [ -4.8065298624e-14 -3.556832098176e-14 -6.568924145279999e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.6375609 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.383889813471621e-18 } }