{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.420700000000001e-10 0.0 0.0 ] "source-value" [ 5.4207 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.21917e-11 5.37017e-10 0.0 ] "source-value" [ -0.121917 5.37017 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.28689e-12 -3.00504e-11 5.4102e-10 ] "source-value" [ -0.0328689 -0.300504 5.4102 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.664889819179664e-09 1.447798315719233e-08 -4.201005313164455e-09 ] [ -1.884331779829874e-09 -1.799154078527584e-08 -1.148666589345959e-09 ] [ -3.263176675579686e-09 1.071671588568484e-08 1.833642276118666e-09 ] [ -2.874695788810675e-10 -4.875649524215596e-09 3.834035890576953e-10 ] [ -2.961515817279883e-09 -4.69613989322688e-10 -5.550746991032759e-09 ] [ 1.181843982156499e-09 -3.084465569418778e-09 1.129523638884745e-08 ] [ 9.905012354083728e-09 9.1209434852735e-09 -1.091883767619355e-08 ] [ -4.355252303849383e-09 -7.894372659917763e-09 8.306974155495256e-09 ] ] "source-value" [ [ 1.0391424999999999 9.036446399999999 -2.6220612999999995 ] [ -1.1761073999999998 -11.229436599999998 -0.7169412999999999 ] [ -2.0367146999999997 6.688847999999999 1.1444694999999998 ] [ -0.17942439999999998 -3.0431410999999997 0.23930169999999998 ] [ -1.8484327999999999 -0.2931099999999999 -3.4645037999999997 ] [ 0.7376489999999999 -1.9251719999999999 7.0499320999999995 ] [ 6.182222499999999 5.692845199999999 -6.815002499999999 ] [ -2.7183346999999998 -4.927279899999999 5.1848054999999995 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 5.12752e-12 -3.3658e-11 -1.35216e-11 ] [ 1.26577e-10 1.35967e-10 1.6251e-10 ] [ 3.38464e-12 2.52642e-10 2.69707e-10 ] [ 1.45988e-10 3.83229e-10 4.06608e-10 ] [ 2.77794e-10 -9.3605e-12 2.9072e-10 ] [ 4.03914e-10 1.38604e-10 3.72159e-10 ] [ 2.13334e-10 2.58123e-10 3.77362e-11 ] [ 4.243520000000001e-10 4.40881e-10 1.44889e-10 ] ] "source-value" [ [ 0.0512752 -0.33658 -0.135216 ] [ 1.26577 1.35967 1.6251 ] [ 0.0338464 2.52642 2.69707 ] [ 1.45988 3.83229 4.06608 ] [ 2.77794 -0.093605 2.9072 ] [ 4.03914 1.38604 3.72159 ] [ 2.13334 2.58123 0.377362 ] [ 4.24352 4.40881 1.44889 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.048969005780909e-18 "source-value" -25.271677 } }