{ "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" [ 5.43856 0 0 ] "si-unit" "m" "si-value" [ 5.43856e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00547847 5.34673 0 ] "si-unit" "m" "si-value" [ -5.47847e-13 5.34673e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0698619 0.130192 5.52638 ] "si-unit" "m" "si-value" [ -6.986190000000001e-12 1.30192e-11 5.526379999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0176967 -0.0436428 -0.0335652 ] [ 1.35227 1.24207 1.37266 ] [ -0.0530244 2.758 2.7242 ] [ 1.3158 4.14206 3.88387 ] [ 2.73162 0.0656859 2.694 ] [ 4.07939 1.42095 3.99542 ] [ 2.69114 2.74306 -0.00706676 ] [ 4.05369 4.20359 1.27338 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.76967e-12 -4.36428e-12 -3.35652e-12 ] [ 1.35227e-10 1.24207e-10 1.37266e-10 ] [ -5.30244e-12 2.758e-10 2.7242e-10 ] [ 1.3158e-10 4.14206e-10 3.88387e-10 ] [ 2.73162e-10 6.568590000000001e-12 2.694e-10 ] [ 4.07939e-10 1.42095e-10 3.99542e-10 ] [ 2.69114e-10 2.74306e-10 -7.06676e-13 ] [ 4.05369e-10 4.20359e-10 1.27338e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6529877 1.0678708 -1.9767803 ] [ -0.7581736 2.1131308 -0.8814291 ] [ 0.2811063 -0.1389164 -1.9769778 ] [ -0.3646862 -0.3316191 2.8834592 ] [ 0.7222414 0.290433 -0.0993277 ] [ -1.0005776 0.3285251 1.7939401 ] [ 0.1372796 -0.7171187 -0.9345049 ] [ -0.6701774 -2.6123055 1.1916205 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.648378247409964e-09 1.710917629794993e-09 -3.16715118111801e-09 ] [ -1.214728016427771e-09 3.385608764452401e-09 -1.412205096912785e-09 ] [ 4.50381941819591e-10 -2.225686083257011e-10 -3.167467611000618e-09 ] [ -5.84291703568393e-10 -5.313123690307373e-10 4.619810917270672e-09 ] [ 1.157158285653861e-09 4.653249625088064e-10 -1.591405187378362e-10 ] [ -1.603102038016174e-09 5.263552345659821e-10 2.874208887335614e-09 ] [ 2.199461656327757e-10 -1.148950815478489e-09 -1.497241902803042e-09 ] [ -1.07374256206853e-09 -4.185374798487255e-09 1.909186505966006e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.023109 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.771538304833006e-18 } }