{ "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" [ [ 7.5693104 -7.5758 9.3197207 ] [ -1.4582265 -3.833184 0.5437146 ] [ -0.8148468 -0.8122958 -0.1553996 ] [ 4.4533544 1.1681259 -5.9287608 ] [ 0.2763142 6.3193267 10.7058581 ] [ 2.6054215 -4.6688242 -19.5903778 ] [ -9.30864 8.3995435 5.8721772 ] [ -3.3226872 1.0031081 -0.7669324 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.21273721584583e-08 -1.213776964385664e-08 1.493183861792581e-08 ] [ -2.336336406131011e-09 -6.141437788024627e-09 8.711268205076238e-10 ] [ -1.305528492493693e-09 -1.301441339934033e-09 -2.489776060016717e-10 ] [ 7.135060303816812e-09 1.871544007130959e-09 -9.498921944075504e-09 ] [ 4.427041512350554e-10 1.012467749793722e-08 1.715267555342231e-08 ] [ 4.174345414629667e-09 -7.480280979865264e-09 -3.138724530379934e-08 ] [ -1.491408537944371e-08 1.345755222109261e-08 9.408265023034807e-09 ] [ -5.323531750071414e-09 1.607156345955108e-09 -1.228761161014034e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.6900922 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.232088593463644e-18 } }