{ "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" [ [ -2.9591752 1.518392 0.9892853999999998 ] [ -1.9009774 1.7049574 -4.0903621999999995 ] [ -2.5834925 0.6633526 -1.0503241999999997 ] [ 3.6088817 0.0634031 -0.22018929999999995 ] [ -0.6117897 -5.761713 0.9684861999999997 ] [ 2.0302663 2.382769 4.4235302999999995 ] [ -5.9429077 -6.8638252 -7.654897599999998 ] [ 8.3591944 6.292664 6.634471399999998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.741121361352276e-09 2.432732183652528e-09 1.585009952237343e-09 ] [ -3.045701572042071e-09 2.731642908245392e-09 -6.553482741436833e-09 ] [ -4.139211317614245e-09 1.062808035823148e-09 -1.682804891364742e-09 ] [ 5.782065934610197e-09 1.015829653431654e-10 -3.527821515168161e-10 ] [ -9.801951622618697e-10 -9.231281940414042e-09 1.55168595999145e-09 ] [ 3.252845226657634e-09 3.817616816019546e-09 7.087276886451009e-09 ] [ -9.52158785495868e-09 -1.099706035530038e-08 -1.226449807038268e-08 ] [ 1.339290594674365e-08 1.008195922641297e-08 1.062959505602126e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -34.597266 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.543093118548264e-18 } }