{ "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" [ 5.42631 0 0 ] "si-unit" "m" "si-value" [ 5.42631e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0419811 5.40206 0 ] "si-unit" "m" "si-value" [ -4.19811e-12 5.40206e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.291495 -0.184222 5.7849 ] "si-unit" "m" "si-value" [ -2.91495e-11 -1.84222e-11 5.7849e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.101951 0.0451697 -0.178669 ] [ 1.35762 1.34832 0.905447 ] [ 0.453616 2.71025 3.0057 ] [ 1.36179 4.05856 4.06079 ] [ 2.63302 -0.145655 3.08939 ] [ 4.07266 1.35506 3.53695 ] [ 2.85903 2.69843 0.171649 ] [ 4.20927 3.69056 1.74197 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.01951e-11 4.51697e-12 -1.78669e-11 ] [ 1.35762e-10 1.34832e-10 9.05447e-11 ] [ 4.53616e-11 2.71025e-10 3.0057e-10 ] [ 1.36179e-10 4.05856e-10 4.06079e-10 ] [ 2.63302e-10 -1.45655e-11 3.08939e-10 ] [ 4.07266e-10 1.35506e-10 3.53695e-10 ] [ 2.85903e-10 2.69843e-10 1.71649e-11 ] [ 4.20927e-10 3.69056e-10 1.74197e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7437216 -1.9672683 -2.2442378 ] [ 0.2413891 0.5101184 4.3949669 ] [ -2.9001656 -5.5975612 -4.8602092 ] [ -0.6658015 0.5568595 8.2104999 ] [ 2.6411445 2.060609 -5.4130462 ] [ 1.134903 1.2087069 3.1046292 ] [ 1.4093825 1.2338159 -2.7562711 ] [ -0.1171305 1.9947198 -0.4363318 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.793749980703969e-09 -3.151911277100961e-09 -3.595665334675626e-09 ] [ 3.867479725359533e-10 8.172997743199026e-10 7.041513216369851e-09 ] [ -4.646577520768404e-09 -8.968281688137193e-09 -7.786913552437071e-09 ] [ -1.066731597393571e-09 8.921872719703775e-10 1.315467098486074e-08 ] [ 4.231579970054505e-09 3.301459564410067e-09 -8.67265606895028e-09 ] [ 1.818315053475782e-09 1.936561936579643e-09 4.974164320493007e-09 ] [ 2.258079691264656e-09 1.976790989351311e-09 -4.4160331170067e-09 ] [ -1.876637486826144e-10 3.195893428606852e-09 -6.990806088715815e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.76171824065424 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.724217336481313e-18 } }