{ "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" [ 5.5612 0 0 ] "si-unit" "m" "si-value" [ 5.5612e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0917257 5.43287 0 ] "si-unit" "m" "si-value" [ -9.17257e-12 5.432870000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0143429 0.0662566 5.45634 ] "si-unit" "m" "si-value" [ -1.43429e-12 6.62566e-12 5.45634e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00266051 0.00288647 -0.0538151 ] [ 1.22385 1.29926 1.47737 ] [ 0.0401458 2.69595 2.81688 ] [ 1.24418 4.12341 4.00905 ] [ 2.75119 0.03974 2.60779 ] [ 4.10264 1.45712 4.11323 ] [ 2.59294 2.8546 -0.123929 ] [ 4.00842 4.13916 1.33335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.66051e-13 2.88647e-13 -5.38151e-12 ] [ 1.22385e-10 1.29926e-10 1.47737e-10 ] [ 4.01458e-12 2.69595e-10 2.81688e-10 ] [ 1.24418e-10 4.12341e-10 4.00905e-10 ] [ 2.75119e-10 3.974e-12 2.60779e-10 ] [ 4.10264e-10 1.45712e-10 4.11323e-10 ] [ 2.59294e-10 2.8546e-10 -1.23929e-11 ] [ 4.00842e-10 4.139160000000001e-10 1.33335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0456361999999997 -0.14594339999999997 0.4726813999999999 ] [ 1.4977468999999999 1.1542422999999997 -2.6696287999999995 ] [ -3.2445959999999996 0.45543209999999995 -1.5112563999999997 ] [ 0.7418187999999999 2.1312330999999998 0.20211869999999998 ] [ -0.012695399999999999 0.24122589999999997 2.1755707999999996 ] [ -0.5432372999999999 -0.34698119999999993 -0.4142278999999999 ] [ 1.2675503999999997 -2.3273364999999995 2.3128152999999996 ] [ 1.3390486999999998 -1.1618722999999997 -0.5680729999999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.67529388730455e-09 -2.338271053665155e-10 7.573190944064075e-10 ] [ 2.399655086825934e-09 1.849300043034418e-09 -4.277216884813458e-09 ] [ -5.198415897969863e-09 7.296826689935513e-10 -2.421299692062957e-09 ] [ 1.188524748021919e-09 3.414611874427385e-09 3.238298584344557e-10 ] [ -2.03402732392836e-11 3.864865004956205e-10 3.485648701372686e-09 ] [ -8.70362108777248e-10 -5.559251710772807e-10 -6.636662625308885e-10 ] [ 2.030839633297353e-09 -3.72880415975534e-09 3.7055386324177e-09 ] [ 2.145392538928075e-09 -1.861524650751838e-09 -9.101532870062818e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.71908 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.722827536397671e-18 } }