{ "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" [ 5.37283 0 0 ] "si-unit" "m" "si-value" [ 5.372830000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.256601 5.36059 0 ] "si-unit" "m" "si-value" [ -2.56601e-11 5.36059e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0433697 -0.246629 5.47376 ] "si-unit" "m" "si-value" [ 4.33697e-12 -2.46629e-11 5.473760000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00270324 -0.00280673 0.144383 ] [ 1.34461 1.35881 1.37149 ] [ -0.0221547 2.59799 2.84643 ] [ 1.34697 4.04373 4.10747 ] [ 2.75027 0.00909757 2.6523 ] [ 4.11164 1.31842 4.20835 ] [ 2.66226 2.78619 -0.017694 ] [ 3.99298 4.09333 1.38778 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.70324e-13 -2.80673e-13 1.44383e-11 ] [ 1.34461e-10 1.35881e-10 1.37149e-10 ] [ -2.21547e-12 2.59799e-10 2.84643e-10 ] [ 1.34697e-10 4.04373e-10 4.10747e-10 ] [ 2.75027e-10 9.09757e-13 2.6523e-10 ] [ 4.11164e-10 1.31842e-10 4.20835e-10 ] [ 2.66226e-10 2.78619e-10 -1.7694e-12 ] [ 3.99298e-10 4.09333e-10 1.38778e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.5833223 3.6817241 -4.1667851 ] [ 0.2487796 0.4079005 0.8067651 ] [ 0.9011554 2.4104344 -1.8293356 ] [ -1.5404142 -2.4909883 1.250993 ] [ 1.6437391 1.0414226 1.3011491 ] [ -0.7207718 -2.9701873 -0.6259706 ] [ -0.8219551 1.2130601 0.7260752 ] [ -2.2938555 -3.2933661 2.5371089 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.138938593051283e-09 5.898772277255921e-09 -6.67592567111779e-09 ] [ 3.985888588519757e-10 6.535286447126304e-10 1.292580181697374e-09 ] [ 1.443810113587672e-09 3.861941641652076e-09 -2.930918729917141e-09 ] [ -2.468015617588335e-09 -3.991003216946337e-09 2.004311737384454e-09 ] [ 2.633560356714833e-09 1.66854294209275e-09 2.084670668194961e-09 ] [ -1.154803726891933e-09 -4.758764651457076e-09 -1.002915460628148e-09 ] [ -1.316917244567326e-09 1.94353653184531e-09 1.163300710382684e-09 ] [ -3.675161653593494e-09 -5.276554169155275e-09 4.064896564003605e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.527537 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.692138917600698e-18 } }