{ "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" [ [ 1.4812575 3.1410396 -2.5727608 ] [ -0.8890306 1.4170035 -2.3737382 ] [ -2.8515683 -2.9970255 -2.0705784 ] [ 0.8838415 -0.8115603 4.3025428 ] [ 2.6180909 0.424662 0.2608158 ] [ 2.1259485 0.1873541 -0.4429774 ] [ -1.5889787 0.8482119 0.3040483 ] [ -1.7795607 -2.2096853 2.592648 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.373236135884656e-09 5.032500212126985e-09 -4.122017204670705e-09 ] [ -1.424384042495796e-09 2.270289879291773e-09 -3.803147847939875e-09 ] [ -4.5687160628744e-09 -4.80176418804143e-09 -3.317432304013471e-09 ] [ 1.416070187792803e-09 -1.300262939029434e-09 6.893433484151371e-09 ] [ 4.194644031109231e-09 6.803835281421696e-10 4.178729770952486e-10 ] [ 3.406144983724828e-09 3.001743588310253e-10 -7.0972803382277e-10 ] [ -2.545824524089177e-09 1.358985275664347e-09 4.871390778539847e-10 ] [ -2.851170548834483e-09 -3.540306126985434e-09 4.153880011563878e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.172459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.635249150584656e-18 } }