{ "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" [ 5.47613 0 0 ] "si-unit" "m" "si-value" [ 5.476130000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0968569 5.44973 0 ] "si-unit" "m" "si-value" [ -9.68569e-12 5.44973e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0334568 0.0277585 5.60527 ] "si-unit" "m" "si-value" [ -3.34568e-12 2.77585e-12 5.60527e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.000509808 0.0158858 0.00549688 ] [ 1.34999 1.33014 1.19729 ] [ 0.0276425 2.69054 2.64154 ] [ 1.36667 4.13087 4.06954 ] [ 2.77416 0.0351576 2.5647 ] [ 4.07457 1.31666 4.03649 ] [ 2.84869 2.60665 0.046702 ] [ 4.10529 4.27129 1.35792 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.098080000000001e-14 1.58858e-12 5.49688e-13 ] [ 1.34999e-10 1.33014e-10 1.19729e-10 ] [ 2.76425e-12 2.69054e-10 2.64154e-10 ] [ 1.36667e-10 4.13087e-10 4.06954e-10 ] [ 2.77416e-10 3.51576e-12 2.5647e-10 ] [ 4.07457e-10 1.31666e-10 4.03649e-10 ] [ 2.84869e-10 2.60665e-10 4.6702e-12 ] [ 4.10529e-10 4.27129e-10 1.35792e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5920372 -0.2106109 -2.9302858 ] [ 0.3849102 0.5984842 1.2951455 ] [ -0.2100475 0.7218065 0.4465776 ] [ 0.0104425 -0.5253787 0.7477925 ] [ -1.1803424 0.2672917 1.3273728 ] [ 0.4928469 0.4847035 0.6424359 ] [ -0.0677967 1.6162298 -1.6608774 ] [ -0.0220502 -2.9525261 0.1318389 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.485481682987847e-10 -3.374358628457105e-10 -4.694835439701996e-09 ] [ 6.166941286282667e-10 9.588774010581827e-10 2.075051857730247e-09 ] [ -3.36533196530115e-10 1.156461508569321e-09 7.154961959877984e-10 ] [ 1.6730729500545e-11 -8.417494771412956e-10 1.198095670580445e-09 ] [ -1.891117013399482e-09 4.282485162021378e-10 2.126685684767155e-09 ] [ 7.896277873193345e-10 7.765806221180189e-10 1.02929578782276e-09 ] [ -1.086222886023078e-10 2.589485620734493e-09 -2.661018962218671e-09 ] [ -3.532831521502679e-11 -4.730468328695147e-09 2.112292050322626e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -25.71162907419016 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.119457132474253e-18 } }