{ "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" [ 5.47225 0 0 ] "si-unit" "m" "si-value" [ 5.47225e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0720088 5.55574 0 ] "si-unit" "m" "si-value" [ -7.20088e-12 5.55574e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0610026 -0.0268755 5.37267 ] "si-unit" "m" "si-value" [ -6.10026e-12 -2.68755e-12 5.37267e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0205094 -0.0758047 0.142316 ] [ 1.30951 1.38319 1.48801 ] [ -0.0602099 2.69484 2.70363 ] [ 1.30902 4.05591 4.11478 ] [ 2.76224 0.0853385 2.86654 ] [ 4.01949 1.17816 4.04456 ] [ 2.72232 2.71295 0.0698342 ] [ 4.15368 4.12703 1.42088 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.05094e-12 -7.580470000000001e-12 1.42316e-11 ] [ 1.30951e-10 1.38319e-10 1.48801e-10 ] [ -6.02099e-12 2.69484e-10 2.70363e-10 ] [ 1.30902e-10 4.05591e-10 4.11478e-10 ] [ 2.76224e-10 8.53385e-12 2.86654e-10 ] [ 4.01949e-10 1.17816e-10 4.04456e-10 ] [ 2.72232e-10 2.71295e-10 6.983420000000001e-12 ] [ 4.15368e-10 4.127030000000001e-10 1.42088e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.154371000000002 7.262051800000002 -10.296069800000001 ] [ 9.040870800000002 -6.832766300000002 -5.231343100000001 ] [ -5.632850300000001 0.31107360000000006 12.172161400000004 ] [ -1.9566405000000004 5.5625686000000005 -2.9163066000000004 ] [ -51.49069090000001 -49.41230270000001 -50.87893200000001 ] [ 53.08887270000002 49.58093870000001 49.952538300000015 ] [ 4.679695800000001 -4.572220500000001 1.3529495000000002 ] [ -13.883628700000003 -1.8993432000000003 5.845002200000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.860389413167215e-09 1.163508970885764e-08 -1.649612245559305e-08 ] [ 1.448507194677289e-08 -1.094729851144264e-08 -8.381535679257125e-09 ] [ -9.024821133479891e-09 4.983948533742624e-10 1.950195258035673e-08 ] [ -3.134883690238077e-09 8.912217435942092e-09 -4.672438292099985e-09 ] [ -8.249718182849645e-08 -7.916723681807513e-08 -8.15170360132749e-08 ] [ 8.505775136534051e-08 7.943742147692635e-08 8.00327896732501e-08 ] [ 7.497699264987938e-09 -7.325504850595798e-09 2.167664075881983e-09 ] [ -2.22440254982718e-08 -3.043083294986789e-09 9.364725950518595e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.086104 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.019236966689393e-18 } }