{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7440121 1.644003 0.1699327 ] [ 1.624629 1.787277 2.54743 ] [ 2.897237 1.241702 0.9240311 ] [ 2.052276 3.648887 1.374272 ] [ 4.460812 2.919724 2.096642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.440121e-11 1.644003e-10 1.699327e-11 ] [ 1.624629e-10 1.787277e-10 2.54743e-10 ] [ 2.897237e-10 1.241702e-10 9.240311e-11 ] [ 2.052276e-10 3.648887e-10 1.374272e-10 ] [ 4.460812e-10 2.919724e-10 2.096642e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.5972558 2.0788898 5.8672662 ] [ -3.3908107 2.6376308 0.4705202 ] [ 1.9827625 4.5407102 -3.3253671 ] [ 2.5824319 -7.2918293 -0.5975302 ] [ -6.7716395 -1.9654015 -2.414889 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.967792383397201e-09 3.330748634779588e-09 9.400396733650057e-09 ] [ -5.432677629098482e-09 4.225950402062001e-09 7.538564640541403e-10 ] [ 3.17673572209896e-09 7.275019724268093e-09 -5.327825423197496e-09 ] [ 4.137512014988123e-09 -1.168279842732443e-08 -9.573489166619482e-10 ] [ -1.08493624913858e-08 -3.148920333785252e-09 -3.869078697627092e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.943521 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.195304308263384e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8402672 1.781473 0.5590585 ] [ 1.8390753 1.8690232 2.5345425 ] [ 3.0202333 1.4156242 0.706413 ] [ 2.2080698 3.4603109 1.0264317 ] [ 3.8713205 2.7151617 2.2858621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.402672e-11 1.781473e-10 5.590585000000001e-11 ] [ 1.8390753e-10 1.8690232e-10 2.5345425e-10 ] [ 3.0202333e-10 1.4156242e-10 7.06413e-11 ] [ 2.2080698e-10 3.4603109e-10 1.0264317e-10 ] [ 3.8713205e-10 2.7151617e-10 2.2858621e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.2e-05 4.37e-05 6e-05 ] [ -4.92e-05 -7.76e-05 8.2e-06 ] [ -1.53e-05 -2.29e-05 -4.69e-05 ] [ 5.5e-06 -2e-07 -7.55e-05 ] [ 3.7e-05 5.7e-05 5.42e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.52478856576e-14 7.001511832895999e-14 9.6130597248e-14 ] [ -7.882708974336e-14 -1.2432890577408e-13 1.313784829056e-14 ] [ -2.451330229824e-14 -3.668984461632e-14 -7.514208351552e-14 ] [ 8.8119714144e-15 -3.2043532416e-16 -1.209643348704e-13 ] [ 5.92805349696e-14 9.13240673856e-14 8.683797284736e-14 ] ] } "relaxed-potential-energy" { "source-value" -28.867458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.625076630952593e-18 } }