{ "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" [ 5.52526 0 0 ] "si-unit" "m" "si-value" [ 5.52526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.163004 5.51064 0 ] "si-unit" "m" "si-value" [ 1.63004e-11 5.510640000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0929221 -0.0543858 5.47616 ] "si-unit" "m" "si-value" [ 9.29221e-12 -5.43858e-12 5.47616e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0515746 -0.0381365 -0.00729456 ] [ 1.44408 1.32704 1.45073 ] [ 0.0791767 2.70101 2.71983 ] [ 1.48556 4.06547 4.00394 ] [ 2.80111 0.011527 2.65388 ] [ 4.15958 1.27318 3.97985 ] [ 2.73428 2.80936 0.100172 ] [ 4.13679 4.02299 1.21489 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.15746e-12 -3.81365e-12 -7.29456e-13 ] [ 1.44408e-10 1.32704e-10 1.45073e-10 ] [ 7.917670000000001e-12 2.70101e-10 2.71983e-10 ] [ 1.48556e-10 4.06547e-10 4.00394e-10 ] [ 2.80111e-10 1.1527e-12 2.65388e-10 ] [ 4.15958e-10 1.27318e-10 3.97985e-10 ] [ 2.73428e-10 2.80936e-10 1.00172e-11 ] [ 4.136790000000001e-10 4.02299e-10 1.21489e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5131481 0.6803298 -0.15960669999999996 ] [ -1.1839397 1.356511 -2.6090925999999994 ] [ -2.0716757 0.0637074 -0.9014577999999998 ] [ 2.5752697 0.4878093 0.5349959999999999 ] [ -0.8028181 -4.0949747 0.5767567999999998 ] [ 1.7566931 1.9389635 3.595538799999999 ] [ -3.5729944 -4.7462673 -5.680238899999999 ] [ 5.8126131 4.3139211 4.643104599999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.026507163601495e-09 1.090008508973893e-09 -2.557181253698477e-10 ] [ -1.896880523404969e-09 2.173370227963974e-09 -4.180227199662307e-09 ] [ -3.319190399765593e-09 1.020705076928916e-10 -1.444294623697045e-09 ] [ 4.126036939588189e-09 7.815566623078961e-10 8.571580904834637e-10 ] [ -1.286256401172275e-09 -6.560872781161159e-09 9.240662684606109e-10 ] [ 2.814532637929025e-09 3.106562013878859e-09 5.760688252000397e-09 ] [ -5.724568141092848e-09 -7.604358566778268e-09 -9.100746041117861e-09 ] [ 9.312832891302303e-09 6.911663587339576e-09 7.439073699337914e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.164359 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.63395143393876e-18 } }