{ "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" [ [ 16.3849557 -18.4538721 7.8064981 ] [ 1.4151191 -3.4408477 2.6384391 ] [ -0.4891002 -2.7993898 1.7688696 ] [ 3.1214973 0.3336825 -5.207953 ] [ -2.0998907 2.0970106 0.8098503 ] [ -10.8246491 17.0418308 -11.43443 ] [ -2.4007356 5.7343217 3.7830437 ] [ -5.1071965 -0.512736 -0.1643178 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.62515929553837e-08 -2.95663624418534e-08 1.250738874613962e-08 ] [ 2.267270737667538e-09 -5.512845740673452e-09 4.227245441424593e-09 ] [ -7.836249056686042e-10 -4.485116890065988e-09 2.834041518363848e-09 ] [ 5.001189995950324e-09 5.34618300270096e-10 -8.344060538825222e-09 ] [ -3.364395785775346e-09 3.35978135688978e-09 1.297523217007866e-09 ] [ -1.734299971638376e-08 2.730402288338936e-08 -1.831997641817414e-08 ] [ -3.84640245104226e-09 9.18739616388611e-09 6.061104171604729e-09 ] [ -8.182630830131587e-09 -8.214936318425087e-10 -2.632661375412903e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.133152 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.826392746212762e-19 } }