{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.735268 2.856882 0.3239211 ] [ 1.752307 5.080999 1.048158 ] [ 2.257155 3.165316 3.087528 ] [ 4.821596 2.368521 1.002197 ] [ 4.597336 2.893151 3.290106 ] [ 3.849033 4.748793 0.5493667 ] [ 3.5339 4.902962 2.909562 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.735268e-10 2.856882e-10 3.239211e-11 ] [ 1.752307e-10 5.080999e-10 1.048158e-10 ] [ 2.257155e-10 3.165316e-10 3.087528e-10 ] [ 4.821596000000001e-10 2.368521e-10 1.002197e-10 ] [ 4.597336e-10 2.893151e-10 3.290106e-10 ] [ 3.849033e-10 4.748793e-10 5.493667e-11 ] [ 3.5339e-10 4.902962e-10 2.909562e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9564864 -7.0254703 -2.3830276 ] [ -6.1521793 6.3908933 -1.2972099 ] [ -5.7827367 -5.3673155 2.5276081 ] [ 2.279025 -2.8083921 0.7740979 ] [ 4.6266287 -3.5527603 0.6844219 ] [ 3.4415193 5.1464078 -1.6661422 ] [ 2.5442294 7.2166371 1.3602519 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.532460148193157e-09 -1.125604426478476e-08 -3.818031107441135e-09 ] [ -9.856877841429711e-09 1.023933983128736e-08 -2.078359374050306e-09 ] [ -9.264965544982142e-09 -8.599387410557463e-09 4.049674604364709e-09 ] [ 3.65140057321872e-09 -4.499540164659415e-09 1.240241557590376e-09 ] [ 7.412676336262298e-09 -5.692149491966394e-09 1.096564766943515e-09 ] [ 5.513921762491981e-09 8.245454258262764e-09 -2.669454079768277e-09 ] [ 4.076304862632012e-09 1.156232724241791e-08 2.179363792578779e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.459253 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.835974724843227e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6773874 2.6374611 0.524917 ] [ 1.3832386 5.5014078 0.9082717 ] [ 2.1543018 2.9183001 2.9271787 ] [ 5.0340879 2.1831097 1.0398862 ] [ 4.7183478 2.7858085 3.3604555 ] [ 3.868929 4.9182574 0.4768089 ] [ 3.7103026 5.0722794 2.9733209 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6773874e-10 2.6374611e-10 5.24917e-11 ] [ 1.3832386e-10 5.5014078e-10 9.082717e-11 ] [ 2.1543018e-10 2.9183001e-10 2.9271787e-10 ] [ 5.0340879e-10 2.1831097e-10 1.0398862e-10 ] [ 4.7183478e-10 2.7858085e-10 3.3604555e-10 ] [ 3.868929e-10 4.9182574e-10 4.768089e-11 ] [ 3.7103026e-10 5.0722794e-10 2.9733209e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.5e-06 -2.15e-05 -2e-07 ] [ -1e-05 2.07e-05 3e-07 ] [ -3.4e-06 3.01e-05 8.8e-06 ] [ 1.78e-05 2.46e-05 -1.88e-05 ] [ -1.11e-05 8.7e-06 -9.4e-06 ] [ 5.4e-06 -3.58e-05 2.47e-05 ] [ -4.1e-06 -2.68e-05 -5.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.8119714144e-15 -3.44467973472e-14 -3.2043532416e-16 ] [ -1.6021766208e-14 3.316505605055999e-14 4.8065298624e-16 ] [ -5.44740051072e-15 4.822551628608e-14 1.409915426304e-14 ] [ 2.851874385024e-14 3.941354487168e-14 -3.012092047104e-14 ] [ -1.778416049088e-14 1.393893660096e-14 -1.506046023552e-14 ] [ 8.65175375232e-15 -5.735792302464001e-14 3.957376253376001e-14 ] [ -6.568924145279999e-15 -4.293833343744e-14 -8.65175375232e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.128129 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.744228784184649e-18 } }