{ "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" [ 5.40836 0 0 ] "si-unit" "m" "si-value" [ 5.40836e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0676972 5.56169 0 ] "si-unit" "m" "si-value" [ 6.76972e-12 5.561689999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0290382 0.0456166 5.46301 ] "si-unit" "m" "si-value" [ 2.90382e-12 4.56166e-12 5.46301e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.160852 -0.0174641 0.0414383 ] [ 1.3693 1.3835 1.35672 ] [ 0.168786 2.76991 2.61562 ] [ 1.32577 4.00891 4.07743 ] [ 2.71647 0.0672876 2.67609 ] [ 4.01486 1.47906 4.19059 ] [ 2.74225 2.69331 -0.0428987 ] [ 4.04746 4.06755 1.1226 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.60852e-11 -1.74641e-12 4.14383e-12 ] [ 1.3693e-10 1.3835e-10 1.35672e-10 ] [ 1.68786e-11 2.76991e-10 2.61562e-10 ] [ 1.32577e-10 4.008910000000001e-10 4.07743e-10 ] [ 2.71647e-10 6.728760000000001e-12 2.67609e-10 ] [ 4.01486e-10 1.47906e-10 4.19059e-10 ] [ 2.74225e-10 2.69331e-10 -4.28987e-12 ] [ 4.04746e-10 4.06755e-10 1.1226e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.9235777 -6.9208649 0.9640937 ] [ 1.5811586 -6.2328928 0.2362943 ] [ 3.454837 1.7743476 1.9867696 ] [ -3.4387477 0.6812682 6.4284859 ] [ -1.6130785 7.6500319 -1.2571495 ] [ -2.1491782 -4.2474879 -4.3546758 ] [ -4.1292076 3.9861435 0.1247808 ] [ 3.3706387 3.3094544 -4.1285992 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.684087840032237e-09 -1.108844793849533e-08 1.544648386400569e-09 ] [ 2.533295342696859e-09 -9.986195124112651e-09 3.785852030883015e-10 ] [ 5.535259070074809e-09 2.84281824189259e-09 3.183155804036168e-09 ] [ -5.509481169769772e-09 1.091511982534499e-09 1.029956981612245e-08 ] [ -2.584436660215133e-09 1.22567022585542e-08 -2.01417553775041e-09 ] [ -3.443363065973027e-09 -6.805225810510888e-09 -6.976959757923536e-09 ] [ -6.615719879149678e-09 6.386505922853884e-09 1.999208804847206e-10 ] [ 5.400358522303706e-09 5.302330467283691e-09 -6.614745114893584e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.838301 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.537575557539326e-18 } }