{ "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" [ 5.55154 0 0 ] "si-unit" "m" "si-value" [ 5.55154e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.061684 5.43974 0 ] "si-unit" "m" "si-value" [ 6.1684e-12 5.43974e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.265567 0.0876051 5.42724 ] "si-unit" "m" "si-value" [ 2.65567e-11 8.760510000000001e-12 5.427240000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0647023 0.102264 0.485367 ] [ 1.35693 1.92881 1.38138 ] [ 0.0777781 2.73495 2.46621 ] [ 1.63547 4.09153 3.75722 ] [ 2.82757 -0.0639025 2.36092 ] [ 4.37612 1.31575 3.25969 ] [ 2.62065 2.47384 -0.106223 ] [ 4.18903 3.98589 0.601522 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.470230000000001e-12 1.02264e-11 4.85367e-11 ] [ 1.35693e-10 1.92881e-10 1.38138e-10 ] [ 7.77781e-12 2.73495e-10 2.46621e-10 ] [ 1.63547e-10 4.09153e-10 3.75722e-10 ] [ 2.82757e-10 -6.390250000000001e-12 2.36092e-10 ] [ 4.37612e-10 1.31575e-10 3.25969e-10 ] [ 2.62065e-10 2.47384e-10 -1.06223e-11 ] [ 4.18903e-10 3.98589e-10 6.01522e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.174025299999999 -3.7497082999999996 -8.599636599999998 ] [ 2.4696930999999998 -5.828134299999999 0.6677980999999998 ] [ -2.4505952999999994 6.1959387999999995 -0.5971688999999999 ] [ -4.146929499999999 3.3284241999999997 8.610464399999998 ] [ -0.3860008999999999 0.6427519999999999 -3.7131148999999994 ] [ -3.1337473999999994 0.38027999999999995 5.834741499999999 ] [ 2.4589353999999997 0.25418199999999996 -6.999335999999999 ] [ -0.9853806999999999 -1.2237343999999999 4.796252499999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.891879073384838e-09 -6.007695022575861e-09 -1.37781368214112e-08 ] [ 3.956884577971025e-09 -9.337700595273944e-09 1.069930512049595e-09 ] [ -3.926286529050219e-09 9.926988371053997e-09 -9.567700581314822e-10 ] [ -6.6441135477453e-09 5.332723481280142e-09 1.379548486956883e-08 ] [ -6.184416226829704e-10 1.029802235856768e-09 -5.949065932137245e-09 ] [ -5.02081686113825e-09 6.0927573037752e-10 9.348286496730108e-09 ] [ 3.939648842395442e-09 4.072444611833879e-10 -1.121417259271502e-08 ] [ -1.578753933134563e-09 -1.960638661902009e-09 7.684443686264082e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.877826 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.306302478991768e-18 } }