{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.40836e-10 0.0 0.0 ] "source-value" [ 5.40836 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 6.76972e-12 5.561689999999999e-10 0.0 ] "source-value" [ 0.0676972 5.56169 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.90382e-12 4.56166e-12 5.46301e-10 ] "source-value" [ 0.0290382 0.0456166 5.46301 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -6.560604682958833e-09 -9.560864014847578e-10 -3.431147270327737e-09 ] [ 3.860535411231999e-09 -5.355453196628908e-10 -5.031843960583104e-10 ] [ -8.202334878867172e-09 -5.54949761370386e-10 1.244651388521466e-09 ] [ 5.979036038775153e-09 5.266116629341411e-09 -6.617396396765683e-10 ] [ -2.824807213192205e-10 -3.72554129634624e-09 1.526999770051809e-09 ] [ 5.936966886154497e-09 -4.197105615269427e-09 -5.30578427942515e-09 ] [ -4.337159403923673e-09 8.971988804402399e-10 3.849983956660397e-10 ] [ 3.606041190689589e-09 3.805912884352051e-09 6.745206191466113e-09 ] ] "source-value" [ [ -4.0948074 -0.5967422 -2.1415537 ] [ 2.4095567 -0.3342611 -0.314063 ] [ -5.1194948 -0.3463724 0.7768503 ] [ 3.7318208 3.2868515 -0.4130254 ] [ -0.1763106 -2.3253 0.9530783 ] [ 3.7055633 -2.6196273 -3.3116101 ] [ -2.707042 0.5599875 0.2402971 ] [ 2.2507139 2.375464 4.2100266 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.527967404055887e-18 "source-value" -34.502859 } }