{ "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" [ 5.40836 0 0 ] "si-unit" "m" "si-value" [ 5.40836e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0676972 5.56169 0 ] "si-unit" "m" "si-value" [ 6.76972e-12 5.561689999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0290382 0.0456166 5.46301 ] "si-unit" "m" "si-value" [ 2.90382e-12 4.56166e-12 5.46301e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.160852 -0.0174641 0.0414383 ] [ 1.3693 1.3835 1.35672 ] [ 0.168786 2.76991 2.61562 ] [ 1.32577 4.00891 4.07743 ] [ 2.71647 0.0672876 2.67609 ] [ 4.01486 1.47906 4.19059 ] [ 2.74225 2.69331 -0.0428987 ] [ 4.04746 4.06755 1.1226 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.60852e-11 -1.74641e-12 4.14383e-12 ] [ 1.3693e-10 1.3835e-10 1.35672e-10 ] [ 1.68786e-11 2.76991e-10 2.61562e-10 ] [ 1.32577e-10 4.008910000000001e-10 4.07743e-10 ] [ 2.71647e-10 6.728760000000001e-12 2.67609e-10 ] [ 4.01486e-10 1.47906e-10 4.19059e-10 ] [ 2.74225e-10 2.69331e-10 -4.28987e-12 ] [ 4.04746e-10 4.06755e-10 1.1226e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1377984 -0.594174 -1.3202747 ] [ 1.1937401 -0.5121798 -0.2758772 ] [ -2.8905197 0.0485919 0.5071041 ] [ 1.745021 2.0720064 0.0120593 ] [ 0.2357324 -1.339479 0.5889785 ] [ 2.2135774 -1.8967425 -2.1955436 ] [ -1.7637278 0.7053743 0.3617084 ] [ 1.403975 1.5166026 2.3218453 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.425130616463647e-09 -9.51971691487219e-10 -2.115313257373734e-09 ] [ 1.912582479531454e-09 -8.206025012060197e-10 -4.420040000517657e-10 ] [ -4.63112308530183e-09 7.785280614025152e-11 8.124703333318252e-10 ] [ 2.795831849005037e-09 3.319720212227973e-09 1.932112852321344e-11 ] [ 3.776849400450739e-10 -2.146081937852563e-09 9.436475828538526e-10 ] [ 3.54654195861125e-09 -3.038916489177744e-09 -3.517648625867067e-09 ] [ -2.825803446615019e-09 1.130134212373166e-09 5.795207420269747e-10 ] [ 2.24941592118768e-09 2.429865228764494e-09 3.720006256774363e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.549459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.695651209188815e-18 } }