{ "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" [ [ -2.3229223 -0.2843863 -1.6363715 ] [ 1.8672862 -0.2889689 -0.3852638 ] [ -3.2227188 0.2772314 -0.2601464 ] [ 1.5882666 1.5736781 0.7107292 ] [ 0.5332085 -0.896185 0.3474463 ] [ 2.561776 -2.946978 -2.2805856 ] [ -2.7660122 0.7453431 0.5404256 ] [ 1.761116 1.8202655 2.9637662 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.721731800994964e-09 -4.55637081135815e-10 -2.621756160243427e-09 ] [ 2.991722293982473e-09 -4.629792157182931e-10 -6.17260653200567e-10 ] [ -5.163364716772631e-09 4.441736676316531e-10 -4.168004800652851e-10 ] [ 2.544683614117505e-09 2.521310260484965e-09 1.138713707959887e-09 ] [ 8.542941927118368e-10 -1.435846654911648e-09 5.56670338843463e-10 ] [ 4.104417614926541e-09 -4.721579253611942e-09 -3.653900930053141e-09 ] [ -4.431640079687574e-09 1.194171289294596e-09 8.658572616018124e-10 ] [ 2.821618881716813e-09 2.916386827748822e-09 4.748476915157257e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -33.669432 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.394437678601539e-18 } }