{ "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" [ 5.36644 0 0 ] "si-unit" "m" "si-value" [ 5.366440000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.227231 5.37948 0 ] "si-unit" "m" "si-value" [ -2.27231e-11 5.379480000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0350261 -0.0899265 5.39939 ] "si-unit" "m" "si-value" [ -3.50261e-12 -8.992650000000001e-12 5.399390000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00104229 0.0077963 0.00224549 ] [ 1.32493 1.37357 1.36608 ] [ -0.0958533 2.66355 2.80902 ] [ 1.19786 4.07015 4.22336 ] [ 2.70129 0.113781 2.60003 ] [ 3.9906 1.45175 3.98519 ] [ 2.48193 2.86985 0.00162227 ] [ 4.00824 4.16333 1.43322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04229e-13 7.7963e-13 2.24549e-13 ] [ 1.32493e-10 1.37357e-10 1.36608e-10 ] [ -9.58533e-12 2.66355e-10 2.80902e-10 ] [ 1.19786e-10 4.07015e-10 4.22336e-10 ] [ 2.70129e-10 1.13781e-11 2.60003e-10 ] [ 3.9906e-10 1.45175e-10 3.98519e-10 ] [ 2.48193e-10 2.86985e-10 1.62227e-13 ] [ 4.00824e-10 4.16333e-10 1.43322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8072066 6.2667015 -2.2896702 ] [ -3.4739421 2.4038452 -1.3151045 ] [ 7.3442436 7.1642369 -6.4517523 ] [ -3.2225251 3.6652767 -9.041494 ] [ 0.9881603 -3.3124929 3.9977552 ] [ -6.5664762 -6.1575739 8.5432698 ] [ 8.5036156 -5.1743085 4.6806122 ] [ -4.3802828 -4.855685 1.8763837 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.293287542675457e-09 1.004036263283229e-08 -3.668456063782461e-09 ] [ -5.565868814632855e-09 3.851384579462301e-09 -2.107029683808874e-09 ] [ 1.176677539338003e-08 1.147837286705267e-08 -1.033684669825263e-08 ] [ -5.163054375161182e-09 5.872420637502976e-09 -1.448607030390348e-08 ] [ 1.583207330262714e-09 -5.307198680945993e-09 6.405109917121628e-09 ] [ -1.052065464867962e-08 -9.865520943428277e-09 1.368782713874669e-08 ] [ 1.362429410659016e-08 -8.290156107506717e-09 7.499167437871254e-09 ] [ -7.017986694652362e-09 -7.77966498496925e-09 3.006298095790201e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -33.784397 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.412857102122566e-18 } }