{ "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" [ 5.42333 0 0 ] "si-unit" "m" "si-value" [ 5.423330000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0707092 5.40512 0 ] "si-unit" "m" "si-value" [ 7.07092e-12 5.40512e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00203562 -0.0726392 5.50089 ] "si-unit" "m" "si-value" [ -2.03562e-13 -7.26392e-12 5.50089e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00542909 0.0277818 -0.0388963 ] [ 1.35422 1.36306 1.38504 ] [ 0.0297601 2.72434 2.72311 ] [ 1.36125 4.06894 4.03995 ] [ 2.72846 0.00923744 2.71344 ] [ 4.08711 1.36473 3.96445 ] [ 2.72619 2.69674 -0.100972 ] [ 4.11061 4.07011 1.39355 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.42909e-13 2.77818e-12 -3.88963e-12 ] [ 1.35422e-10 1.36306e-10 1.38504e-10 ] [ 2.97601e-12 2.72434e-10 2.72311e-10 ] [ 1.36125e-10 4.06894e-10 4.03995e-10 ] [ 2.72846e-10 9.23744e-13 2.71344e-10 ] [ 4.08711e-10 1.36473e-10 3.96445e-10 ] [ 2.72619e-10 2.69674e-10 -1.00972e-11 ] [ 4.11061e-10 4.07011e-10 1.39355e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8686404 -0.7319919 0.2768258 ] [ -0.5633793 0.3753344 0.3369843 ] [ 0.2849727 -0.2958085 0.4736678 ] [ -1.028377 0.5140797 -0.6861168 ] [ 0.8499118 -0.2118122 0.2253257 ] [ -0.4258423 0.5883327 -1.3724835 ] [ 0.3900806 -0.7604937 -0.0225881 ] [ -0.376007 0.5223597 0.7683848 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.391715352228413e-09 -1.172780318457265e-09 4.435238284483571e-10 ] [ -9.026331505392761e-10 6.013520056164095e-10 5.399083714848462e-10 ] [ 4.565766012678918e-10 -4.739374668385889e-10 7.588994814381852e-10 ] [ -1.647641600343018e-09 8.236464833537297e-10 -1.099280305154851e-09 ] [ 1.361708826920881e-09 -3.393605576361348e-10 3.610115715796937e-10 ] [ -6.822745828288181e-10 9.426129049581318e-10 -2.198960994250539e-09 ] [ 6.249780226967003e-10 -1.218445236444206e-09 -3.61901260264554e-11 ] [ -6.024296296204379e-10 8.369125058832498e-10 1.231088172480763e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.1071806015624759 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.773898889441463e-19 } }