{ "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" [ [ 0.8070865 2.620947 2.881943 ] [ 2.981493 2.883992 2.450576 ] [ 2.14387 2.287305 4.61196 ] [ 1.117537 4.809867 2.516966 ] [ 2.97789 5.94727 2.412215 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.070865000000001e-11 2.620947e-10 2.881943e-10 ] [ 2.981493e-10 2.883992e-10 2.450576e-10 ] [ 2.14387e-10 2.287305e-10 4.61196e-10 ] [ 1.117537e-10 4.809867e-10 2.516966e-10 ] [ 2.97789e-10 5.947269999999999e-10 2.412215e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7428375 -1.348931 -0.577643 ] [ -0.7481049 5.2603504 0.256049 ] [ 1.1031169 -0.0798496 0.6036107 ] [ 0.0187324 -2.3343568 -0.1935138 ] [ 2.369093 -1.497213 -0.088503 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.39451011715352e-09 -2.161225711272365e-09 -9.254861097687744e-10 ] [ -1.198596180685922e-09 8.428010428095928e-09 4.102357215792192e-10 ] [ 1.767388107189372e-09 -1.279331623002317e-10 9.670909516047224e-10 ] [ 3.001261333147392e-11 -3.740051889565502e-09 -3.10043286162167e-10 ] [ 3.795705417100934e-09 -2.39879966495783e-09 -1.417974374706624e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -15.116013 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.421852262830887e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7634798 2.2539136 2.8558343 ] [ 2.7714096 3.1361771 1.9995308 ] [ 2.2331253 3.4085247 4.2877669 ] [ 1.0121953 4.5849249 2.6368913 ] [ 3.2476666 5.1658407 3.0936368 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.634798000000001e-11 2.2539136e-10 2.8558343e-10 ] [ 2.7714096e-10 3.1361771e-10 1.9995308e-10 ] [ 2.2331253e-10 3.4085247e-10 4.2877669e-10 ] [ 1.0121953e-10 4.5849249e-10 2.6368913e-10 ] [ 3.2476666e-10 5.1658407e-10 3.0936368e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.97e-05 -2.7e-06 -7e-06 ] [ 1.5e-05 -2.18e-05 -8.2e-06 ] [ -3.74e-05 -1.4e-06 -1e-07 ] [ -1.5e-05 1.43e-05 3.6e-05 ] [ 1.76e-05 1.17e-05 -2.07e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.156287942976e-14 -4.32587687616e-15 -1.12152363456e-14 ] [ 2.4032649312e-14 -3.492745033344e-14 -1.313784829056e-14 ] [ -5.992140561792e-14 -2.24304726912e-15 -1.6021766208e-16 ] [ -2.4032649312e-14 2.291112567744e-14 5.76783583488e-14 ] [ 2.819830852608e-14 1.874546646336e-14 -3.316505605055999e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.398784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.268245481754911e-18 } }