{ "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" [ [ 149.3509452 -185.973552 66.5411108 ] [ 0.4539865 -9.416693 -0.8350694 ] [ 4.2769594 -13.6435128 9.9729006 ] [ 3.4644647 -0.0472583 -13.0768778 ] [ -4.1850624 4.2745542 3.3340474 ] [ -108.8203722 159.2433503 -64.9382987 ] [ -30.9242664 33.508752 16.0610094 ] [ -13.6166548 12.0543596 -17.0588223 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.39286592693822e-07 -2.979624771015331e-07 1.066106120458224e-07 ] [ 7.273665564588192e-10 -1.508720536985101e-08 -1.337928669425483e-09 ] [ 6.852444358790796e-09 -2.185931723374555e-08 1.597834818288229e-08 ] [ 5.550684345926886e-09 -7.571614339875265e-11 -2.095146788421854e-08 ] [ -6.705209133869138e-09 6.848590803582447e-09 5.341732796919026e-09 ] [ -1.743494562055943e-07 2.551359728685247e-07 -1.04042623971667e-07 ] [ -4.954613664147098e-08 5.368693904658524e-08 2.573257376712904e-08 ] [ -2.18162859740641e-08 1.931321312983604e-08 -2.733124626744168e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 55.345452 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.867318926200861e-18 } }