{ "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" [ [ 17.9143394 -20.3675844 5.7299779 ] [ 0.3663399 -4.2906726 1.4215443 ] [ -0.7130626 -3.5760703 1.6787907 ] [ 6.1333865 -0.5907369 -1.6902408 ] [ -2.3847422 2.9745144 1.7889454 ] [ -12.5944829 16.9314593 -9.8029277 ] [ -2.6805406 7.4470374 3.3789212 ] [ -6.0412374 1.4720531 -2.5050111 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.87019357637563e-08 -3.26324675478508e-08 9.18043662908068e-09 ] [ 5.8694122304621e-10 -6.87441532722715e-09 2.277565042891502e-09 ] [ -1.142452226886862e-09 -5.729496228997243e-09 2.689719210756467e-09 ] [ 9.82676845663034e-09 -9.464648502238675e-10 -2.708064293282288e-09 ] [ -3.820778199475158e-09 4.76569742991294e-09 2.866206495767705e-09 ] [ -2.017858605344539e-08 2.712718824648674e-08 -1.570602157633272e-08 ] [ -4.294699480425205e-09 1.193146921650322e-08 5.413628550165482e-09 ] [ -9.67912932298258e-09 2.358489061396164e-09 -4.013470219264491e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.203511 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.397176960307563e-18 } }