{ "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" [ [ 28.7998304 -30.5670551 15.8032155 ] [ 4.8145 -8.1396695 9.5420787 ] [ -1.1006683 -5.1173958 1.2199962 ] [ 7.4287945 1.2363949 -15.0784176 ] [ -5.6346082 5.2081005 -1.4559665 ] [ -17.1575347 29.3980287 -25.2939718 ] [ -4.6578556 9.8323679 9.836624 ] [ -12.4924581 -1.8507717 5.4264413 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.614241494988512e-08 -4.897382104792541e-08 2.531954240756418e-08 ] [ 7.7136793408416e-09 -1.304118817393883e-08 1.528809540697366e-08 ] [ -1.763465017515681e-09 -8.198971910140111e-09 1.954649389104841e-09 ] [ 1.190224086862763e-08 1.980923002856354e-09 -2.415828815737925e-08 ] [ -9.02763752540797e-09 8.34429685987679e-09 -2.332715486968004e-09 ] [ -2.748940096690474e-08 4.710083428074742e-08 -4.05254102651345e-08 ] [ -7.462707345382357e-09 1.575318997648439e-08 1.576000900040018e-08 ] [ -2.001512430414359e-08 -2.965263148178272e-09 8.694117385003559e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.38489936 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.166767559528828e-20 } }