{ "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" [ 5.39006 0 0 ] "si-unit" "m" "si-value" [ 5.39006e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.23331 5.36322 0 ] "si-unit" "m" "si-value" [ 2.3331e-11 5.36322e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.160148 -0.0213292 5.4933 ] "si-unit" "m" "si-value" [ -1.60148e-11 -2.13292e-12 5.4933e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.105355 0.0424721 -0.0304949 ] [ 1.33629 1.36991 1.45967 ] [ -0.05353 2.71357 2.83859 ] [ 1.26119 4.17265 4.20892 ] [ 2.69817 -0.0783338 2.63037 ] [ 3.99124 1.24872 4.05842 ] [ 2.76699 2.61469 0.0747626 ] [ 4.02836 3.96527 1.47431 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.05355e-11 4.24721e-12 -3.04949e-12 ] [ 1.33629e-10 1.36991e-10 1.45967e-10 ] [ -5.353e-12 2.71357e-10 2.83859e-10 ] [ 1.26119e-10 4.17265e-10 4.20892e-10 ] [ 2.69817e-10 -7.83338e-12 2.63037e-10 ] [ 3.99124e-10 1.24872e-10 4.05842e-10 ] [ 2.76699e-10 2.61469e-10 7.47626e-12 ] [ 4.02836e-10 3.96527e-10 1.47431e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.516472 2.6511083 4.483502 ] [ 0.0695582 -0.075358 -0.7984986 ] [ 0.8146755 -0.3307967 0.3261311 ] [ 4.920792 -4.8359835 -4.0762781 ] [ -4.1018699 3.2124122 4.629317 ] [ -0.5233134 0.9329066 0.7525681 ] [ -0.591799 0.5845158 -1.0524365 ] [ 3.9284285 -2.1388047 -4.264305 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.236185846897819e-09 4.247543737468833e-09 7.183362083710041e-09 ] [ 1.114445218249306e-10 -1.207368257902464e-10 -1.279335788661531e-09 ] [ 1.30525403963855e-09 -5.299947389777914e-10 5.225196237357869e-10 ] [ 7.883977898219673e-09 -7.748099702274558e-09 -6.530917471699044e-09 ] [ -6.571920055343234e-09 5.146851723212693e-09 7.416983467671994e-09 ] [ -8.384404948313587e-10 1.494681143910017e-09 1.205747015379876e-09 ] [ -9.481665220128192e-10 9.364975492482087e-10 -1.686189155176579e-09 ] [ 6.294036299184413e-09 -3.426742886797158e-09 -6.832169774960544e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.607978 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.544809324476075e-18 } }