{ "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" [ 5.42446 0 0 ] "si-unit" "m" "si-value" [ 5.42446e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00225581 5.46076 0 ] "si-unit" "m" "si-value" [ -2.25581e-13 5.46076e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0117255 0.0343157 5.56103 ] "si-unit" "m" "si-value" [ -1.17255e-12 3.43157e-12 5.56103e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0182071 0.00139191 0.0164222 ] [ 1.32892 1.32964 1.49498 ] [ -0.00509802 2.67752 2.7579 ] [ 1.15566 4.0451 4.18086 ] [ 2.64397 0.106198 2.73506 ] [ 4.03699 1.34406 4.11378 ] [ 2.695 2.72586 0.109097 ] [ 4.00933 4.13019 1.43696 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.82071e-12 1.39191e-13 1.64222e-12 ] [ 1.32892e-10 1.32964e-10 1.49498e-10 ] [ -5.098020000000001e-13 2.67752e-10 2.7579e-10 ] [ 1.15566e-10 4.0451e-10 4.18086e-10 ] [ 2.64397e-10 1.06198e-11 2.73506e-10 ] [ 4.036990000000001e-10 1.34406e-10 4.11378e-10 ] [ 2.695e-10 2.72586e-10 1.09097e-11 ] [ 4.009330000000001e-10 4.13019e-10 1.43696e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0150884 -0.1122036 0.2209723 ] [ -0.1972203 0.8389863 -1.7492497 ] [ -1.2111588 0.4256623 0.2052953 ] [ 2.2804487 0.6411912 0.1078653 ] [ 0.1321355 -2.1311845 1.4900046 ] [ -0.0607397 0.6903196 1.0475007 ] [ -0.4756772 -0.3533072 -1.1205726 ] [ 0.5473001 0.0005358 -0.201816 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.626350902525279e-09 -1.797699846895949e-10 3.540366529044039e-10 ] [ -3.159817538071622e-10 1.344204235031495e-09 -2.802606973281414e-09 ] [ -1.940490313436183e-09 6.819861854159558e-10 3.289193300201223e-10 ] [ 3.653681592073753e-09 1.027301550102697e-09 1.728192618555783e-10 ] [ 2.117044088777184e-10 -3.414533980511337e-09 2.387250535004456e-09 ] [ -9.731572729440577e-11 1.106013924000008e-09 1.678281131811635e-09 ] [ -7.621188888876058e-10 -5.660605358003098e-10 -1.79535522162907e-09 ] [ 8.768714247815019e-10 8.5844623342464e-13 -3.233448769033728e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -26.905689 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.310766588231574e-18 } }