{ "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" [ [ 2.1166978999999997 1.6751094999999998 -4.637547999999999 ] [ 0.7167031999999999 -0.20828929999999998 2.0063029999999995 ] [ -1.1469462999999998 4.974382699999999 2.1861646999999995 ] [ -1.8097516999999999 2.3763584999999994 4.363768799999999 ] [ -0.8415180999999999 -1.0811018999999997 -1.2714679999999998 ] [ -0.6152462999999999 -3.2031264999999998 7.490905399999999 ] [ 2.7411342999999997 -3.8109242999999995 -6.407342699999999 ] [ -1.1610728999999997 -0.7224086999999999 -3.7307831999999994 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.391323888676456e-09 2.683821278179978e-09 -7.430170983437797e-09 ] [ 1.148285111092546e-09 -3.337162468227975e-10 3.214451760840902e-09 ] [ -1.837610547173063e-09 7.969839664851977e-09 3.502621971558245e-09 ] [ -2.899541863193055e-09 3.807346031339356e-09 6.99152834993647e-09 ] [ -1.348260625800036e-09 -1.732116188882459e-09 -2.037116303695334e-09 ] [ -9.857332378937029e-10 -5.131974391764931e-09 1.200175350050447e-08 ] [ 4.391781289932973e-09 -6.105773817098605e-09 -1.026569467539355e-08 ] [ -1.860243855424456e-09 -1.157426329802521e-09 -5.97737362031341e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -213.13318 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.414769981127582e-17 } }