{ "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" [ 5.45864 0 0 ] "si-unit" "m" "si-value" [ 5.45864e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.103818 5.38839 0 ] "si-unit" "m" "si-value" [ 1.03818e-11 5.388390000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.113176 0.0705962 5.39093 ] "si-unit" "m" "si-value" [ 1.13176e-11 7.05962e-12 5.39093e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.000432489 -6.72518e-05 0.0122781 ] [ 1.51992 1.38746 1.2495 ] [ 0.155886 2.80678 2.64329 ] [ 1.56947 4.13166 3.92938 ] [ 2.77407 -0.0290867 2.65575 ] [ 4.2526 1.27774 3.82666 ] [ 2.78396 2.65139 -0.0871139 ] [ 4.18696 3.99308 1.34271 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.32489e-14 -6.72518e-15 1.22781e-12 ] [ 1.51992e-10 1.38746e-10 1.2495e-10 ] [ 1.55886e-11 2.80678e-10 2.64329e-10 ] [ 1.56947e-10 4.13166e-10 3.92938e-10 ] [ 2.77407e-10 -2.90867e-12 2.65575e-10 ] [ 4.2526e-10 1.27774e-10 3.82666e-10 ] [ 2.78396e-10 2.65139e-10 -8.71139e-12 ] [ 4.18696e-10 3.99308e-10 1.34271e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.042503900000000004 0.17049580000000003 0.18215760000000003 ] [ -0.32216520000000004 -0.16172690000000003 -0.009183800000000002 ] [ 0.15878340000000002 -0.23138660000000005 0.22374370000000005 ] [ -0.30082990000000004 -0.20861100000000005 0.4831603000000001 ] [ -0.014374900000000003 0.34450870000000006 -0.14081490000000002 ] [ 0.17099600000000004 0.15552340000000003 0.17263570000000003 ] [ 0.4515689000000001 0.11995240000000003 -0.32505950000000006 ] [ -0.10147450000000002 -0.18875580000000006 -0.5866391000000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.809875487282112e-11 2.731643847045927e-10 2.918486480210382e-10 ] [ -5.161655514753563e-10 -2.591150581344596e-10 -1.471406965010304e-11 ] [ 2.543990512511347e-10 -3.707222008864013e-10 3.584769251912891e-10 ] [ -4.81982632617602e-10 -3.342316670417088e-10 7.741081367587144e-10 ] [ -2.303112870633792e-11 5.519637848022011e-10 -2.2561034064029e-10 ] [ 2.739657934503169e-10 2.491759554673268e-10 2.765928824554426e-10 ] [ 7.234931342603733e-10 1.9218493088885e-10 -5.208027312689377e-10 ] [ -1.625800715073697e-10 -3.024201298004007e-10 -9.398994508671534e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 153.06667 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.452398400977087e-17 } }