{ "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" [ [ 1.407318 2.912531 0.4915679 ] [ 2.588763 3.80351 2.492541 ] [ 3.156708 1.860824 1.786936 ] [ 3.58937 3.640178 0.244631 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.407318e-10 2.912531e-10 4.915679e-11 ] [ 2.588763e-10 3.80351e-10 2.492541e-10 ] [ 3.156708e-10 1.860824e-10 1.786936e-10 ] [ 3.58937e-10 3.640178e-10 2.44631e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5271652 -0.2419903 0.0452286 ] [ -1.239711 3.9775557 1.3966975 ] [ 1.3338528 -4.5931723 -0.9004074 ] [ 1.4330234 0.8576068 -0.5415188 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.446788399697937e-09 -3.877112043146501e-10 7.24642061085324e-11 ] [ -1.986235997112774e-09 6.372746802973513e-09 2.237756099266215e-09 ] [ 2.137067789355475e-09 -7.359073334996037e-09 -1.442611697360691e-09 ] [ 2.295956607455236e-09 1.374037576119511e-09 -8.67608768231719e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.8400533 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.576550347457459e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3542949 2.889773 0.5723409 ] [ 2.5283765 3.9514015 2.451524 ] [ 3.1911773 1.7086198 1.698218 ] [ 3.6683103 3.6672487 0.293593 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3542949e-10 2.889773e-10 5.723409000000001e-11 ] [ 2.5283765e-10 3.9514015e-10 2.451524e-10 ] [ 3.1911773e-10 1.7086198e-10 1.698218e-10 ] [ 3.6683103e-10 3.6672487e-10 2.93593e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.97e-05 -1.22e-05 3.2e-06 ] [ 3e-07 1.27e-05 2.2e-06 ] [ -1.3e-06 -8.5e-06 -7.1e-06 ] [ 2.07e-05 8.1e-06 1.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.15628796898e-14 -1.95465549348e-14 5.1269652288e-15 ] [ 4.806529901999999e-16 2.03476432518e-14 3.5247885948e-15 ] [ -2.0828296242e-15 -1.3618501389e-14 -1.13754541014e-14 ] [ 3.316505632379999e-14 1.29776307354e-14 2.5634826144e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.513842 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.684503198596783e-18 } }