{ "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" [ 5.56073 0 0 ] "si-unit" "m" "si-value" [ 5.56073e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.133996 5.45738 0 ] "si-unit" "m" "si-value" [ 1.33996e-11 5.45738e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.257535 0.146511 5.42452 ] "si-unit" "m" "si-value" [ 2.57535e-11 1.46511e-11 5.42452e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.021946 -0.143129 0.447254 ] [ 1.34917 1.36629 1.27067 ] [ 0.149131 2.79951 2.69143 ] [ 1.55983 4.18842 3.90967 ] [ 2.84034 0.059242 2.59602 ] [ 4.26988 1.39211 3.97128 ] [ 2.60434 2.82137 -0.639913 ] [ 3.66815 4.10108 1.28502 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1946e-12 -1.43129e-11 4.47254e-11 ] [ 1.34917e-10 1.36629e-10 1.27067e-10 ] [ 1.49131e-11 2.79951e-10 2.69143e-10 ] [ 1.55983e-10 4.18842e-10 3.90967e-10 ] [ 2.84034e-10 5.9242e-12 2.59602e-10 ] [ 4.26988e-10 1.39211e-10 3.97128e-10 ] [ 2.60434e-10 2.82137e-10 -6.399129999999999e-11 ] [ 3.66815e-10 4.10108e-10 1.28502e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.0332747 -4.8385522 -2.7472894 ] [ 4.1977382 3.5290921 3.1140747 ] [ -0.1678385 -0.7321099 0.2365101 ] [ -23.8886903 23.4413275 -16.7418508 ] [ -8.1995976 14.5833689 13.7332845 ] [ 0.2012513 -0.180417 -1.9208704 ] [ 23.8843883 -21.913993 18.3199989 ] [ 8.0060234 -13.8887164 -13.9938577 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.462018429604134e-09 -7.752215213360406e-09 -4.40164284725166e-09 ] [ 6.725518004279075e-09 5.654228855269976e-09 4.989297679764774e-09 ] [ -2.689069207701408e-10 -1.172969365636226e-09 3.789309528030701e-10 ] [ -3.827390110019174e-08 3.755714688101612e-08 -2.682340194068178e-08 ] [ -1.313720357468779e-08 2.336513270408181e-08 2.200314735269502e-08 ] [ 3.22440127765607e-10 -2.890598993948736e-10 -3.077573646466744e-09 ] [ 3.826700853636906e-08 -3.511008725297485e-08 2.935187393066172e-08 ] [ 1.282706351705773e-08 -2.225217670900154e-08 -2.242063164174206e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -54.075183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.663799396808162e-18 } }