{ "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" [ [ 0.9626266 2.1432948 -1.5857461 ] [ -0.7522453 1.4666993 -2.0822955 ] [ -2.1660373 -1.9736752 -0.9997937 ] [ 0.733326 -1.2402091 3.3740052 ] [ 1.8690287 0.3112378 0.0192596 ] [ 1.7378044 0.0643316 -0.4079105 ] [ -1.3639447 0.7336361 0.1301071 ] [ -1.0205583 -1.5053152 1.552374 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.542297833080193e-09 3.433936820042212e-09 -2.540645327944779e-09 ] [ -1.205229832766682e-09 2.349911328203725e-09 -3.336205167697046e-09 ] [ -3.470374321840756e-09 -3.162176262492764e-09 -1.601846091763129e-09 ] [ 1.174917772624781e-09 -1.987034024923409e-09 5.405752249897628e-09 ] [ 2.994514086744217e-09 4.986579266692263e-10 3.085728084595968e-11 ] [ 2.784269581203371e-09 1.030705854986573e-10 -6.535446664788384e-10 ] [ -2.18528031040407e-09 1.175414607594891e-09 2.084545538200877e-10 ] [ -1.635114648423393e-09 -2.411780820374876e-09 2.487177329537779e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -40.89415 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.551965105748833e-18 } }