{ "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" [ [ 24.9021464 -27.5322778 9.0370412 ] [ 1.7618295 -4.4341456 2.2181204 ] [ -0.3756437 -3.7297002 1.972088 ] [ 3.7370212 -0.1401797 -3.6323244 ] [ -2.1599507 2.0567431 1.1126621 ] [ -18.8001981 25.5630904 -10.687143 ] [ -2.784692 7.8642948 1.9713212 ] [ -6.2805127 0.3521749 -1.9917654 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.989763676981889e-08 -4.411157180853086e-08 1.447893613184638e-08 ] [ 2.822762034735754e-09 -7.104284413543188e-09 3.553820646999545e-09 ] [ -6.01847553890809e-10 -5.975638463033084e-09 3.159633287760231e-09 ] [ 5.987367998073961e-09 -2.245926380507577e-10 -5.819625232841387e-09 ] [ -3.460622513620595e-09 3.295265709811716e-09 1.782681203470232e-09 ] [ -3.012123786222858e-08 4.095658579427692e-08 -1.712269065774638e-08 ] [ -4.461568418528794e-09 1.259998926763901e-08 3.158404738727401e-09 ] [ -1.006249061457748e-08 5.64246391212578e-10 -3.19115995799836e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.81643 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.893200788731975e-18 } }