{ "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" [ [ 1.5449448 0.2461246 0.8312209 ] [ -1.1008627 0.1890814 0.0451562 ] [ 2.3410202 -0.0095329 -0.140723 ] [ -1.510756 -1.2296796 -0.240354 ] [ -0.1992541 0.6900273 -0.5297003 ] [ -2.016812 1.9349663 1.921229 ] [ 2.2078995 -0.6728759 -0.2196153 ] [ -1.2661795 -1.1481113 -1.6672135 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.475274459379803e-09 3.943350831725964e-10 1.331762703672451e-09 ] [ -1.763776495182152e-09 3.029418010040076e-10 7.234820852023079e-11 ] [ 3.750727864162006e-09 -1.52733896342586e-11 -2.25463102466382e-10 ] [ -2.420497962875304e-09 -1.970163922426466e-09 -3.85089562688436e-10 ] [ -3.192402632486994e-10 1.105545616882108e-09 -8.486734436827902e-10 ] [ -3.231289061570808e-09 3.100157793437433e-09 3.078148212363186e-09 ] [ 3.537444989120282e-09 -1.07806604456172e-09 -3.518625021289001e-10 ] [ -2.028643209349803e-09 -1.839477098091364e-09 -2.671170513589359e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.3569006015624794 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.718178044839483e-20 } }