{ "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" [ 5.46847 0 0 ] "si-unit" "m" "si-value" [ 5.46847e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0752926 5.44594 0 ] "si-unit" "m" "si-value" [ 7.52926e-12 5.44594e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00412544 0.201844 5.40303 ] "si-unit" "m" "si-value" [ 4.12544e-13 2.01844e-11 5.40303e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00347607 -0.00350605 -0.096896 ] [ 1.33363 1.43287 1.45525 ] [ -0.0378093 2.6958 2.61111 ] [ 1.37012 4.12622 4.01894 ] [ 2.67267 0.0858706 2.76525 ] [ 3.9434 1.3374 3.96298 ] [ 2.74102 2.68949 -0.0467586 ] [ 4.13757 3.9786 1.32692 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.47607e-13 -3.50605e-13 -9.6896e-12 ] [ 1.33363e-10 1.43287e-10 1.45525e-10 ] [ -3.78093e-12 2.6958e-10 2.61111e-10 ] [ 1.37012e-10 4.12622e-10 4.01894e-10 ] [ 2.67267e-10 8.58706e-12 2.76525e-10 ] [ 3.9434e-10 1.3374e-10 3.96298e-10 ] [ 2.74102e-10 2.68949e-10 -4.67586e-12 ] [ 4.137570000000001e-10 3.9786e-10 1.32692e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.17716629999999997 -0.5777293999999998 1.1762466999999999 ] [ 0.46640789999999993 -1.0497398999999998 -2.1184559999999997 ] [ -0.22040719999999997 0.37194199999999994 2.0394911999999996 ] [ -0.6581329999999999 0.2811351999999999 -0.43836469999999994 ] [ -0.4146928999999999 -2.0270318999999994 -1.6723628999999998 ] [ 1.6161359999999998 2.0234521999999995 1.1235419999999998 ] [ -0.0026688999999999997 -0.9501098999999998 0.46004519999999993 ] [ -0.6094756999999998 1.9280817999999997 -0.5701415999999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.83851703853639e-10 -9.256245378288113e-10 1.884554963033151e-09 ] [ 7.472678331364241e-10 -1.68186872570093e-09 -3.394140675393484e-09 ] [ -3.531312628959897e-10 5.959167766935935e-10 3.267625118967337e-09 ] [ -1.054445305976966e-09 4.50428244723932e-10 -7.023376737240057e-10 ] [ -6.644112691917522e-10 -3.247663119795803e-09 -2.679420739873288e-09 ] [ 2.589335315233229e-09 3.241927808146325e-09 1.800112724886873e-09 ] [ -4.27604918325312e-12 -1.522243868970626e-09 7.370736639512601e-10 ] [ -9.764877174857142e-10 3.089127582949981e-09 -9.134675420655052e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -25.683959 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.115023863938575e-18 } }