{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.43182 0 0 ] "si-unit" "m" "si-value" [ 5.43182e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00436542 5.42411 0 ] "si-unit" "m" "si-value" [ -4.36542e-13 5.42411e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.250705 -0.013062 5.36378 ] "si-unit" "m" "si-value" [ 2.50705e-11 -1.3062e-12 5.36378e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00336868 -0.0347308 0.0739509 ] [ 1.33721 1.36002 1.29514 ] [ 0.0804819 2.71297 2.74807 ] [ 1.4297 4.00589 4.14244 ] [ 2.76212 -0.0429027 2.66501 ] [ 4.31635 1.33651 3.99144 ] [ 2.62716 2.67896 0.144482 ] [ 3.97118 3.97277 1.25678 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.36868e-13 -3.47308e-12 7.395090000000001e-12 ] [ 1.33721e-10 1.36002e-10 1.29514e-10 ] [ 8.04819e-12 2.71297e-10 2.74807e-10 ] [ 1.4297e-10 4.00589e-10 4.14244e-10 ] [ 2.76212e-10 -4.29027e-12 2.66501e-10 ] [ 4.31635e-10 1.33651e-10 3.99144e-10 ] [ 2.62716e-10 2.67896e-10 1.44482e-11 ] [ 3.97118e-10 3.97277e-10 1.25678e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7874905 0.7821518 -0.3920335 ] [ -0.3719237 -1.4041259 2.4686915 ] [ 0.1333225 1.0062862 -1.6646292 ] [ 1.6581497 -0.4703197 -1.174318 ] [ -0.1122569 0.5159 0.5893873 ] [ -2.0261221 -1.3809665 1.6333096 ] [ 0.2453788 -0.2370228 -3.8889513 ] [ 2.2609421 1.1880968 2.4285435 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.863875512596977e-09 1.253145338201041e-09 -6.28106913445239e-10 ] [ -5.958874617708258e-10 -2.24965770817422e-09 3.95527983785441e-09 ] [ 2.13606194286465e-10 1.61224823675665e-09 -2.667030008514113e-09 ] [ 2.656648705014109e-09 -7.535352338498898e-10 -1.881464860485612e-09 ] [ -1.798553821852746e-10 8.265629254806e-10 9.44302560436348e-10 ] [ -3.246205486251011e-09 -2.212552258636761e-09 2.616850477207886e-09 ] [ 3.931401798389592e-10 -3.797523918852552e-10 -6.230786903623923e-09 ] [ 3.622428603446891e-09 1.903540931890171e-09 3.890955650352579e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.942115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.758561682954091e-18 } }