{ "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" [ 5.56756 0 0 ] "si-unit" "m" "si-value" [ 5.56756e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.603325 5.38792 0 ] "si-unit" "m" "si-value" [ 6.033250000000001e-11 5.387920000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.402741 -0.450618 5.48706 ] "si-unit" "m" "si-value" [ -4.02741e-11 -4.50618e-11 5.48706e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.336492 0.0638405 0.189929 ] [ 1.53887 1.35333 1.11771 ] [ 0.318438 2.15889 3.01891 ] [ 1.68585 3.81794 4.45016 ] [ 2.72641 -0.320403 2.65546 ] [ 4.33601 0.74819 4.56114 ] [ 3.14234 2.88247 0.0769818 ] [ 4.12798 3.93896 1.35009 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.36492e-11 6.38405e-12 1.89929e-11 ] [ 1.53887e-10 1.35333e-10 1.11771e-10 ] [ 3.18438e-11 2.15889e-10 3.01891e-10 ] [ 1.68585e-10 3.81794e-10 4.45016e-10 ] [ 2.72641e-10 -3.20403e-11 2.65546e-10 ] [ 4.33601e-10 7.481900000000001e-11 4.56114e-10 ] [ 3.14234e-10 2.88247e-10 7.698180000000001e-12 ] [ 4.12798e-10 3.93896e-10 1.35009e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.496451000000002 14.801030900000004 -13.788290200000004 ] [ -0.5109428000000001 0.06382710000000004 -1.9608996000000005 ] [ 0.7156528000000001 -1.6644184000000004 0.7618376000000002 ] [ 3.061788400000001 -2.5120022000000004 5.343922300000001 ] [ 4.648629100000001 -6.9847236000000015 -8.963099700000003 ] [ 8.566012200000001 -14.459286800000003 15.378004400000004 ] [ 2.2329364000000003 9.435206800000001 4.335395900000001 ] [ -12.217624900000004 1.3203663000000003 -1.1068707000000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.040846199612594e-08 2.371386586709199e-08 -2.209127638125119e-08 ] [ -8.186206154705353e-10 1.022622882359815e-10 -3.141707520739947e-09 ] [ 1.146602194216675e-09 -2.666692269679666e-09 1.220598401622639e-09 ] [ 4.905525832732247e-09 -4.024671229396595e-09 8.56190744297154e-09 ] [ 7.44792492415245e-09 -1.119076094686836e-08 -1.436046890755241e-08 ] [ 1.372426459339894e-08 -2.316633145526463e-08 2.463827932722919e-08 ] [ 3.577558525288078e-09 1.511686787191791e-08 6.946070010119401e-09 ] [ -1.957479313775659e-08 2.115460034181034e-09 -1.773402372399224e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 10.553272398437521 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.690820644901373e-18 } }