{ "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" [ 5.39198 0 0 ] "si-unit" "m" "si-value" [ 5.39198e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0815956 5.53401 0 ] "si-unit" "m" "si-value" [ 8.15956e-12 5.534010000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.109849 -0.0410552 5.55668 ] "si-unit" "m" "si-value" [ -1.09849e-11 -4.10552e-12 5.55668e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0600222 -0.0188866 -0.0475744 ] [ 1.35953 1.30974 1.45574 ] [ -0.0201429 2.70129 2.75612 ] [ 1.43727 3.87805 4.08993 ] [ 2.67575 -0.0837777 2.76281 ] [ 3.98871 1.3119 4.2787 ] [ 2.73779 2.77507 0.256836 ] [ 4.26747 4.05038 1.42682 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.00222e-12 -1.88866e-12 -4.75744e-12 ] [ 1.35953e-10 1.30974e-10 1.45574e-10 ] [ -2.01429e-12 2.70129e-10 2.75612e-10 ] [ 1.43727e-10 3.87805e-10 4.08993e-10 ] [ 2.67575e-10 -8.37777e-12 2.76281e-10 ] [ 3.98871e-10 1.3119e-10 4.2787e-10 ] [ 2.73779e-10 2.77507e-10 2.56836e-11 ] [ 4.26747e-10 4.05038e-10 1.42682e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7935026000000005 -1.2687115000000002 1.0795875000000001 ] [ -0.6933807000000001 0.4361615000000001 -0.29761760000000004 ] [ 0.9454557000000002 -1.4771328000000001 0.8216407000000002 ] [ -0.7353310000000001 1.7174885000000004 0.6802377000000001 ] [ 0.7659714000000002 -0.6729726000000001 0.4393242000000001 ] [ -0.8883804000000002 1.0349701000000002 -1.0318232000000003 ] [ 0.7008905000000001 -1.1011337000000003 -1.4051391000000002 ] [ -1.8887281000000005 1.3313305000000002 -0.2862102000000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.873507935064015e-09 -2.0326999038401e-09 1.72968985260792e-09 ] [ -1.110918346853939e-09 6.988077581930594e-10 -4.768359606586061e-10 ] [ 1.514787018542099e-09 -2.366627637976843e-09 1.316413520237747e-09 ] [ -1.178130136749485e-09 2.751719921192862e-09 1.089860939526764e-09 ] [ 1.227221469281446e-09 -1.07822096615899e-09 7.038749621916636e-10 ] [ -1.423342307256953e-09 1.658204897447038e-09 -1.653163007839043e-09 ] [ 1.122950372840822e-09 -1.764210670515002e-09 -2.251281014991954e-09 ] [ -3.026076004868005e-09 2.133026601657975e-09 -4.585592910744923e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.492174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.846690802496562e-18 } }