{ "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" [ 5.21631 0 0 ] "si-unit" "m" "si-value" [ 5.21631e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.340777 5.491 0 ] "si-unit" "m" "si-value" [ 3.40777e-11 5.491e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0764414 0.261433 5.31631 ] "si-unit" "m" "si-value" [ 7.644140000000001e-12 2.61433e-11 5.31631e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.102562 0.0713388 -0.561849 ] [ 1.48031 1.58239 0.779774 ] [ 0.554166 2.97803 2.26105 ] [ 1.29704 4.12978 3.93608 ] [ 3.06699 -0.246774 2.56051 ] [ 4.28292 1.50929 4.5131 ] [ 2.82838 2.54855 -0.698649 ] [ 4.65405 4.12903 1.02077 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.02562e-11 7.133879999999999e-12 -5.61849e-11 ] [ 1.48031e-10 1.58239e-10 7.79774e-11 ] [ 5.541660000000001e-11 2.97803e-10 2.26105e-10 ] [ 1.29704e-10 4.12978e-10 3.93608e-10 ] [ 3.06699e-10 -2.46774e-11 2.56051e-10 ] [ 4.28292e-10 1.50929e-10 4.5131e-10 ] [ 2.82838e-10 2.54855e-10 -6.98649e-11 ] [ 4.65405e-10 4.12903e-10 1.02077e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 33.4448518 -37.8392231 13.0516201 ] [ 3.9223531 -3.6404111 2.7502435 ] [ 1.0504842 -4.0492976 1.2447647 ] [ 5.0415739 0.0765185 -4.9881918 ] [ -2.2629757 2.4364636 1.402463 ] [ -28.910979 32.358093 -15.161242 ] [ -5.7045791 8.1542608 3.2633345 ] [ -6.5807292 2.5035959 -1.562992 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.358456008155284e-08 -6.062511909953304e-08 2.091100076006474e-08 ] [ 6.284302487117465e-09 -5.832581602574236e-09 4.406375873510379e-09 ] [ 1.683061239626183e-09 -6.487689998832278e-09 1.994332917168019e-09 ] [ 8.077491901164252e-09 1.22596152768729e-10 -7.991964347870401e-09 ] [ -3.625686789849794e-09 3.903645049511522e-09 2.246993448649542e-09 ] [ -4.632049501986468e-08 5.184338052539895e-08 -2.429098767481942e-08 ] [ -9.139743340824748e-09 1.306456612130215e-08 5.228438284826073e-09 ] [ -1.054349055892151e-08 4.0112028519582e-09 -2.504189261528928e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.7849348 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.407501726777346e-18 } }