{ "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" [ [ 0.6549178 -0.4945362 -1.8335736 ] [ -2.7676566 -0.474089 2.2650717 ] [ 0.886764 0.5373898 -2.0401876 ] [ -1.8793351 2.4753211 -1.2421034 ] [ 0.1636348 -0.947541 1.86694 ] [ -1.095744 -0.3545976 2.0895915 ] [ 3.7854046 0.1104015 -1.6796994 ] [ 0.2520146 -0.8523486 0.5739609 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.04929398770577e-09 -7.92334337779273e-10 -2.937708754436091e-09 ] [ -4.434274698922817e-09 -7.595743119784513e-10 3.629044922175711e-09 ] [ 1.420752548967091e-09 8.60993373816388e-10 -3.268740874766062e-09 ] [ -3.01102675986883e-09 3.965901595392939e-09 -1.990069028096191e-09 ] [ 2.621718509092838e-10 -1.518128037449453e-09 2.991167620436352e-09 ] [ -1.755575419181875e-09 -5.681279845117901e-10 3.347894648322404e-09 ] [ 6.064886750388775e-09 1.768827022012512e-10 -2.691175108651788e-09 ] [ 4.037719002202636e-10 -1.365612999691611e-09 9.195867352333267e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.146371 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.631069392216312e-18 } }