{ "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" [ [ -2.0077111 -0.671671 -1.1009441 ] [ 1.0488941 -0.1942788 -0.2582556 ] [ -2.9897719 0.0443815 0.4158075 ] [ 1.4487979 2.0767322 -0.1732983 ] [ 0.2268052 -1.659171 0.7509403 ] [ 2.7000639 -1.8073947 -2.2039635 ] [ -2.0378708 0.4711455 0.4835638 ] [ 1.6107928 1.7402563 2.0861498 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.216707785740651e-09 -1.076135573069357e-09 -1.763906897827697e-09 ] [ 1.680513604715057e-09 -3.11268951277079e-10 -4.137710845106764e-10 ] [ -4.790142639704796e-09 7.110700169603519e-11 6.66197055253296e-10 ] [ 2.321230123644137e-09 3.32729177850255e-09 -2.776544846843846e-10 ] [ 3.633819889158682e-10 -2.658284986109357e-09 1.203138992276538e-09 ] [ 4.32597925524607e-09 -2.89576553289783e-09 -3.531138792796541e-09 ] [ -3.265028951970992e-09 7.548583050951264e-10 7.74754615025207e-10 ] [ 2.58077456511297e-09 2.788197958059911e-09 3.342380437046596e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.691219038775916 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.674228091657862e-18 } }