{ "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" [ 5.5048 0 0 ] "si-unit" "m" "si-value" [ 5.5048e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0192448 5.36034 0 ] "si-unit" "m" "si-value" [ 1.92448e-12 5.36034e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.190348 0.0157222 5.58687 ] "si-unit" "m" "si-value" [ 1.90348e-11 1.57222e-12 5.58687e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0113409 -0.0687251 -0.0764128 ] [ 1.39555 1.34846 1.39039 ] [ 0.152538 2.8802 2.74744 ] [ 1.52254 4.15487 3.86439 ] [ 2.76536 0.0171046 2.52424 ] [ 4.13989 1.28016 4.0502 ] [ 2.78466 2.66896 -0.17742 ] [ 4.2307 4.05829 1.13615 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.13409e-12 -6.87251e-12 -7.641280000000001e-12 ] [ 1.39555e-10 1.34846e-10 1.39039e-10 ] [ 1.52538e-11 2.8802e-10 2.74744e-10 ] [ 1.52254e-10 4.15487e-10 3.864390000000001e-10 ] [ 2.76536e-10 1.71046e-12 2.52424e-10 ] [ 4.13989e-10 1.28016e-10 4.0502e-10 ] [ 2.78466e-10 2.66896e-10 -1.7742e-11 ] [ 4.2307e-10 4.058290000000001e-10 1.13615e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.4386227 3.8564682 -1.9041431 ] [ -2.3416133 2.2986225 -2.6653836 ] [ -3.7903494 -2.7212374 0.295553 ] [ 1.6143309 -0.8570987 4.5707829 ] [ 3.8609273 0.6930415 -0.7516572 ] [ 2.1755384 -0.7833562 -1.156241 ] [ -2.2951829 1.0648235 0.3533799 ] [ -1.6622737 -3.5512633 1.2577092 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.907104309081991e-09 6.178743239804039e-09 -3.050773582612325e-09 ] [ -3.751678115123632e-09 3.682799259886664e-09 -4.270415324566802e-09 ] [ -6.072809243375919e-09 -4.359902977846912e-09 4.73528110708602e-10 ] [ 2.58644324752419e-09 -1.373223510171776e-09 7.323201561466758e-09 ] [ 6.185887505632708e-09 1.110374897692311e-09 -1.204287602617865e-09 ] [ 3.485596790849745e-09 -1.255074999739031e-09 -1.852502313472794e-09 ] [ -3.677288413136358e-09 1.706035331034099e-09 5.661770187052565e-10 ] [ -2.663256081452726e-09 -5.689751080441731e-09 2.015072292606833e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -324.38994 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.197299821726619e-17 } }