{ "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" [ [ 0.4346089 3.8501396 -1.9401225 ] [ -1.6512396 1.9249304 -0.6972882 ] [ 4.8349989 5.1562521 -4.9774307 ] [ -1.961673 2.7621412 -5.6444619 ] [ 0.6040974 -2.2589662 2.4837687 ] [ -4.6121719 -4.5484924 5.9483385 ] [ 5.1923137 -3.9032887 3.0618235 ] [ -2.8409344 -2.9827161 1.7653727 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.963202245084425e-10 6.168603704758105e-09 -3.108418936597665e-09 ] [ -2.645577504255506e-09 3.084078508956274e-09 -1.117178861203919e-09 ] [ 7.746522262995703e-09 8.26122663363343e-09 -7.974723164894264e-09 ] [ -3.142946644148682e-09 4.42543809044872e-09 -9.043424967683243e-09 ] [ 9.678707389401516e-10 -3.619262862635771e-09 3.979436175400556e-09 ] [ -7.389514050171383e-09 -7.287488243206581e-09 9.530288955822607e-09 ] [ 8.319003686538083e-09 -6.253757950896235e-09 4.905582069132099e-09 ] [ -4.55167871440681e-09 -4.778838041275607e-09 2.828438890241491e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.805854 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.576512600521543e-18 } }