{ "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" [ 5.46497 0 0 ] "si-unit" "m" "si-value" [ 5.46497e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00264453 5.45437 0 ] "si-unit" "m" "si-value" [ 2.64453e-13 5.45437e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00434361 0.134648 5.52148 ] "si-unit" "m" "si-value" [ -4.343610000000001e-13 1.34648e-11 5.521480000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.000601708 -0.00129581 -0.00103934 ] [ 1.36071 1.38338 1.29931 ] [ 0.0379757 2.81246 2.65752 ] [ 1.43056 4.2109 3.80234 ] [ 2.71672 0.059655 2.71923 ] [ 4.18219 1.40754 3.91392 ] [ 2.71688 2.7266 0.0375018 ] [ 4.08381 4.07468 1.29537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.017079999999999e-14 -1.29581e-13 -1.03934e-13 ] [ 1.36071e-10 1.38338e-10 1.29931e-10 ] [ 3.79757e-12 2.812460000000001e-10 2.65752e-10 ] [ 1.43056e-10 4.2109e-10 3.80234e-10 ] [ 2.71672e-10 5.9655e-12 2.71923e-10 ] [ 4.18219e-10 1.40754e-10 3.91392e-10 ] [ 2.71688e-10 2.7266e-10 3.75018e-12 ] [ 4.08381e-10 4.07468e-10 1.29537e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3230731 -0.3723299 -1.5390612 ] [ -0.2161104 -0.105697 0.5590621 ] [ -0.0185518 -0.4659018 -0.908963 ] [ -1.6511565 -1.4371046 4.2554695 ] [ 1.9730953 1.2484679 -2.598318 ] [ -0.7205343 0.3887933 2.0475298 ] [ 0.3228164 -0.0994852 -2.3873232 ] [ -0.0126318 0.8432572 0.5716041 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.176201676293805e-10 -5.965382610048018e-10 -2.465847872620393e-09 ] [ -3.462470303917363e-10 -1.693452622886976e-10 8.957162261953517e-10 ] [ -2.972326023375744e-11 -7.464569715486374e-10 -1.45631926777223e-09 ] [ -2.645444341581955e-09 -2.302495391764136e-09 6.818013743427467e-09 ] [ 3.161247160270362e-09 2.000266081199273e-09 -4.162964353003815e-09 ] [ -1.154423209944493e-09 6.229155355836807e-10 3.2805043759513e-09 ] [ 5.172088888908211e-10 -1.593928615556121e-10 -3.824913417333442e-09 ] [ -2.023837463862144e-11 1.35104697116127e-09 9.158107253734252e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.798056 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.735480839328917e-18 } }