{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.49393e-10 0.0 0.0 ] "source-value" [ 5.49393 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.595e-13 5.45604e-10 0.0 ] "source-value" [ 0.002595 5.45604 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.981170000000001e-12 7.48179e-12 5.57684e-10 ] "source-value" [ -0.0698117 0.0748179 5.57684 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 5.276361747743117e-10 4.378940965840896e-10 -1.289145755893027e-09 ] [ -8.962741842035454e-09 -6.949911972428854e-09 7.100498309970576e-09 ] [ 2.525300321141405e-09 2.283107292258173e-09 -3.450213652768243e-09 ] [ -4.148278481662238e-09 4.165899540573121e-09 -4.870724273065594e-09 ] [ 1.027024693982623e-09 -8.697838760640692e-10 2.228085983617307e-09 ] [ -2.120556380365302e-09 -2.762234685919847e-09 2.546309022299307e-09 ] [ 1.16867596488017e-08 5.188351302044656e-09 -2.695341408736516e-09 ] [ -5.351441346370425e-10 -1.493321857264931e-09 4.305316143585273e-10 ] ] "source-value" [ [ 0.3293246 0.273312 -0.8046215 ] [ -5.5941035 -4.3377939 4.4317825 ] [ 1.5761685 1.4250035 -2.153454 ] [ -2.5891518 2.60015 -3.040067 ] [ 0.6410184 -0.5428764 1.3906619 ] [ -1.3235472 -1.7240513 1.5892811 ] [ 7.2943017 3.2383142 -1.6822998 ] [ -0.3340107 -0.9320582 0.2687167 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -9.418427308905218e-18 "source-value" -58.7852 } }