{ "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" [ 5.39006 0 0 ] "si-unit" "m" "si-value" [ 5.39006e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.23331 5.36322 0 ] "si-unit" "m" "si-value" [ 2.3331e-11 5.36322e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.160148 -0.0213292 5.4933 ] "si-unit" "m" "si-value" [ -1.60148e-11 -2.13292e-12 5.4933e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.105355 0.0424721 -0.0304949 ] [ 1.33629 1.36991 1.45967 ] [ -0.05353 2.71357 2.83859 ] [ 1.26119 4.17265 4.20892 ] [ 2.69817 -0.0783338 2.63037 ] [ 3.99124 1.24872 4.05842 ] [ 2.76699 2.61469 0.0747626 ] [ 4.02836 3.96527 1.47431 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.05355e-11 4.24721e-12 -3.04949e-12 ] [ 1.33629e-10 1.36991e-10 1.45967e-10 ] [ -5.353e-12 2.71357e-10 2.83859e-10 ] [ 1.26119e-10 4.17265e-10 4.20892e-10 ] [ 2.69817e-10 -7.83338e-12 2.63037e-10 ] [ 3.99124e-10 1.24872e-10 4.05842e-10 ] [ 2.76699e-10 2.61469e-10 7.47626e-12 ] [ 4.02836e-10 3.96527e-10 1.47431e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9509792 0.8549698 2.8917571 ] [ 0.0395238 0.0831675 -0.497428 ] [ 0.5856836 -0.2621992 0.2435694 ] [ 3.102501 -2.7234691 -2.3953381 ] [ -2.6092459 1.526681 2.9267628 ] [ -0.4447619 0.7398446 0.5251694 ] [ -0.3865292 0.3761622 -0.8616933 ] [ 2.6638079 -0.5951567 -2.8327993 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.727989882707087e-09 1.369812625050052e-09 4.633105618652407e-09 ] [ 6.332410832517504e-11 1.33249024110384e-10 -7.969675121313024e-10 ] [ 9.38368571105979e-10 -4.200894282324634e-10 3.902411982222835e-10 ] [ 4.970754568208622e-09 -4.363478519491218e-09 -3.837754702731492e-09 ] [ -4.180472778898255e-09 2.446012605619565e-09 4.689190932787147e-09 ] [ -7.125871180025875e-10 1.185361721145127e-09 8.414141346395635e-10 ] [ -6.192880474965274e-10 6.026782824686938e-10 -1.380584859560001e-09 ] [ 4.267890739682344e-09 -9.535461504524793e-10 -4.538644809878606e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.051266 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.013655270664193e-18 } }