{ "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" [ 5.46856 0 0 ] "si-unit" "m" "si-value" [ 5.46856e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.109414 5.47364 0 ] "si-unit" "m" "si-value" [ 1.09414e-11 5.47364e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0853482 0.188746 5.50226 ] "si-unit" "m" "si-value" [ 8.53482e-12 1.88746e-11 5.50226e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.111998 0.00598912 -0.142628 ] [ 1.42992 1.39997 1.14788 ] [ 0.0344059 2.83471 2.60329 ] [ 1.5648 4.17845 4.01026 ] [ 2.81953 0.00757671 2.62729 ] [ 4.17997 1.38562 3.91338 ] [ 2.81257 2.67111 -0.166315 ] [ 4.15871 3.96748 1.06238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.11998e-11 5.98912e-13 -1.42628e-11 ] [ 1.42992e-10 1.39997e-10 1.14788e-10 ] [ 3.44059e-12 2.83471e-10 2.60329e-10 ] [ 1.5648e-10 4.17845e-10 4.01026e-10 ] [ 2.81953e-10 7.576710000000001e-13 2.62729e-10 ] [ 4.17997e-10 1.38562e-10 3.91338e-10 ] [ 2.81257e-10 2.67111e-10 -1.66315e-11 ] [ 4.15871e-10 3.96748e-10 1.06238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0109745 -0.8904309 -0.3403243 ] [ -0.17172 -0.0103327 1.8806611 ] [ 1.0511754 -0.3475661 -0.0853058 ] [ -1.0551599 0.1022693 -0.6781264 ] [ -0.1892425 -0.3293978 -1.5089228 ] [ 0.3018316 0.4994904 0.7139534 ] [ 0.0716273 -1.2787247 -1.2436153 ] [ 1.0024626 2.2546925 1.2616801 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.61975970812497e-09 -1.426627570417903e-09 -5.452596369501255e-10 ] [ -2.75125769323776e-10 -1.655481036974016e-11 3.013151246068011e-09 ] [ 1.684168650240088e-09 -5.568622796026348e-10 -1.366749583786406e-10 ] [ -1.690552522985666e-09 1.638534814855814e-10 -1.086478264027269e-09 ] [ -3.03199909161744e-10 -5.277534541029543e-10 -2.417560832752074e-09 ] [ 4.835875329386572e-10 8.002718411940403e-10 1.143879445820671e-09 ] [ 1.147595854710278e-10 -2.048742818779494e-09 -1.992491358929179e-09 ] [ 1.606122140946382e-09 3.612415610593104e-09 2.021434359148606e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.485333 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.845594753470273e-18 } }