{ "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" [ 5.49393 0 0 ] "si-unit" "m" "si-value" [ 5.49393e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.002595 5.45604 0 ] "si-unit" "m" "si-value" [ 2.595e-13 5.45604e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0698117 0.0748179 5.57684 ] "si-unit" "m" "si-value" [ -6.981170000000001e-12 7.48179e-12 5.57684e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0568347 0.000259582 0.0366732 ] [ 1.4042 1.34788 1.25876 ] [ -0.0116956 2.70772 2.89683 ] [ 1.4664 4.01047 4.21293 ] [ 2.72042 0.0465962 2.58375 ] [ 4.04434 1.40284 4.02526 ] [ 2.59741 2.72967 0.138309 ] [ 4.11134 4.10597 1.37335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.683470000000001e-12 2.59582e-14 3.66732e-12 ] [ 1.4042e-10 1.34788e-10 1.25876e-10 ] [ -1.16956e-12 2.70772e-10 2.89683e-10 ] [ 1.4664e-10 4.01047e-10 4.21293e-10 ] [ 2.72042e-10 4.65962e-12 2.583750000000001e-10 ] [ 4.04434e-10 1.40284e-10 4.02526e-10 ] [ 2.59741e-10 2.72967e-10 1.38309e-11 ] [ 4.11134e-10 4.10597e-10 1.37335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3506781 0.0869338 -1.8190701 ] [ -2.8643551 -1.0757437 2.3932172 ] [ 0.621234 0.9220415 -1.8139743 ] [ -2.5152913 1.8557902 -1.3460158 ] [ 0.824339 -0.6890155 2.0027173 ] [ 0.4282168 -1.8680265 0.9808656 ] [ 3.3099415 1.5593933 -0.9753738 ] [ -0.1547631 -0.7913732 0.577634 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.618482532465644e-10 1.39283301917303e-10 -2.914471585816318e-09 ] [ -4.589202774889247e-09 -1.723531406112889e-09 3.834356646336438e-09 ] [ 9.953265908460672e-10 1.477273334707363e-09 -2.906307214192046e-09 ] [ -4.02994091536164e-09 2.973303671549756e-09 -2.156555045987409e-09 ] [ 1.320736673413651e-09 -1.103924525468822e-09 3.2087068361317e-09 ] [ 6.860789455937895e-10 -2.992908385334851e-09 1.571519932466965e-09 ] [ 5.303110887515683e-09 2.49842348789216e-09 -1.562721098900855e-09 ] [ -2.479578205825325e-10 -1.267919639367683e-09 9.254716901791873e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.224381 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.803785634115173e-18 } }