{ "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" [ [ 1.137834 0.6178187 0.8180482 ] [ 0.8147489 0.2195668 2.521416 ] [ 0.6602072 2.742467 0.5700192 ] [ 2.747217 2.135327 0.0253318 ] [ 2.249122 2.278269 1.668886 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.137834e-10 6.178187000000001e-11 8.180482000000001e-11 ] [ 8.147489e-11 2.195668e-11 2.521416e-10 ] [ 6.602072e-11 2.742467e-10 5.700191999999999e-11 ] [ 2.747217e-10 2.135327e-10 2.53318e-12 ] [ 2.249122e-10 2.278269e-10 1.668886e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.6022073 -17.6778199 -16.5947478 ] [ -4.2000848 -8.0648204 18.4133886 ] [ -19.4966094 15.0978968 -6.9882101 ] [ 19.9796157 0.9622837 -25.1161726 ] [ 10.3192858 9.6824599 30.2857419 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.057790218173509e-08 -2.832298975049299e-08 -2.658771695323224e-08 ] [ -6.729277671937444e-09 -1.29212666958309e-08 2.950150072462524e-08 ] [ -3.123701176554952e-08 2.418949727621113e-08 -1.119634684345843e-08 ] [ 3.201087316710863e-08 1.541748446716921e-09 -4.024054454369755e-08 ] [ 1.653331845211342e-08 1.551301088361351e-08 4.852310761576298e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 12.962166 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.076767932012865e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8351203 0.5278208 0.0780278 ] [ 1.2757587 0.382829 2.5314892 ] [ 0.1819601 2.8517687 0.7162269 ] [ 3.1077586 1.5614718 0.1145044 ] [ 2.2085314 2.6695582 2.163453 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.351203000000001e-11 5.278208e-11 7.80278e-12 ] [ 1.2757587e-10 3.82829e-11 2.5314892e-10 ] [ 1.819601e-11 2.8517687e-10 7.162269000000001e-11 ] [ 3.1077586e-10 1.5614718e-10 1.145044e-11 ] [ 2.2085314e-10 2.6695582e-10 2.163453e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.6e-06 -7e-06 2.1e-06 ] [ -2.9e-06 -5.5e-06 -5.3e-06 ] [ 3e-07 3.1e-06 2.4e-06 ] [ 1.8e-06 1.9e-06 3.4e-06 ] [ 3.3e-06 7.5e-06 -2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.16565921408e-15 -1.12152363456e-14 3.36457090368e-15 ] [ -4.646312200320001e-15 -8.8119714144e-15 -8.491536090240001e-15 ] [ 4.8065298624e-16 4.96674752448e-15 3.84522388992e-15 ] [ 2.88391791744e-15 3.04413557952e-15 5.44740051072e-15 ] [ 5.28718284864e-15 1.2016324656e-14 -4.16565921408e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.458486 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.835851837896411e-18 } }