{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.512586 2.352376 3.000619 ] [ 5.747731 2.138199 1.702882 ] [ 4.441387 1.564453 3.266826 ] [ 5.259627 4.180433 2.034508 ] [ 3.39507 3.451757 1.390248 ] [ 4.402652 3.245897 4.59308 ] [ 3.137856 4.41534 3.36482 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.512586e-10 2.352376e-10 3.000619e-10 ] [ 5.747731e-10 2.138199e-10 1.702882e-10 ] [ 4.441387e-10 1.564453e-10 3.266826e-10 ] [ 5.259627e-10 4.180433e-10 2.034508e-10 ] [ 3.39507e-10 3.451757e-10 1.390248e-10 ] [ 4.402652e-10 3.245897e-10 4.59308e-10 ] [ 3.137856000000001e-10 4.41534e-10 3.36482e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.7177383 -9.9989325 -0.6203288 ] [ 6.8763403 -4.8459182 -5.9439981 ] [ 0.7437297 -11.6078766 6.1476429 ] [ 8.7146243 10.0669458 1.0451547 ] [ -5.8663537 0.8197195 -17.8508769 ] [ 9.0331572 2.7816206 11.1211675 ] [ -5.7837596 12.7844413 6.1012386 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.197823959451274e-08 -1.60200558844573e-08 -9.93876300568919e-10 ] [ 1.101711166532486e-08 -7.764016846349219e-09 -9.52333478989962e-09 ] [ 1.191586337534598e-09 -1.85978685056514e-08 9.849609727407113e-09 ] [ 1.396236731251557e-08 1.612902520362075e-08 1.674522425459238e-09 ] [ -9.398934747483578e-09 1.313335418513866e-09 -2.860025762995878e-08 ] [ 1.447271327785119e-08 4.456647493255669e-09 1.781807456450078e-08 ] [ -9.26660441144756e-09 2.048293296084996e-08 9.775261842842523e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.0086607 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.024759075059763e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3616728 2.5749477 2.713997 ] [ 6.0976932 2.2436244 2.0063828 ] [ 4.333121 1.3269799 3.510362 ] [ 4.870199 4.3849619 1.6544636 ] [ 2.9581303 3.3333032 0.3755114 ] [ 4.741518 2.9940993 5.3682169 ] [ 3.5345748 4.4905386 3.7240492 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3616728e-10 2.5749477e-10 2.713997e-10 ] [ 6.0976932e-10 2.2436244e-10 2.0063828e-10 ] [ 4.333121e-10 1.3269799e-10 3.510362e-10 ] [ 4.870199e-10 4.384961900000001e-10 1.6544636e-10 ] [ 2.9581303e-10 3.3333032e-10 3.755114e-11 ] [ 4.741518e-10 2.9940993e-10 5.3682169e-10 ] [ 3.5345748e-10 4.4905386e-10 3.7240492e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.4e-06 7e-06 -7.2e-06 ] [ 2.27e-05 9e-06 4.08e-05 ] [ -1.47e-05 -9.3e-06 -3.1e-06 ] [ -3.92e-05 -3e-07 -4.35e-05 ] [ -9.5e-06 1.32e-05 -5e-06 ] [ 1.83e-05 -2.83e-05 3.52e-05 ] [ 1.3e-05 8.7e-06 -1.72e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.506046023552e-14 1.12152363456e-14 -1.153567166976e-14 ] [ 3.636940929216e-14 1.44195895872e-14 6.536880612864e-14 ] [ -2.355199632576e-14 -1.490024257344e-14 -4.96674752448e-15 ] [ -6.280532353535999e-14 -4.8065298624e-16 -6.969468300480001e-14 ] [ -1.52206778976e-14 2.114873139456e-14 -8.010883104e-15 ] [ 2.931983216064e-14 -4.534159836864e-14 5.639661705216e-14 ] [ 2.08282960704e-14 1.393893660096e-14 -2.755743787776e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.813779 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.334735010429801e-18 } }