{ "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" [ [ 2.682391 2.686577 1.562325 ] [ 1.212844 1.781832 3.455784 ] [ 1.883235 4.08794 3.099932 ] [ 4.668223 1.307552 1.415877 ] [ 3.293332 1.297731 3.803317 ] [ 4.485506 3.146522 2.925064 ] [ 3.343094 3.696236 5.003524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.682391e-10 2.686577e-10 1.562325e-10 ] [ 1.212844e-10 1.781832e-10 3.455784e-10 ] [ 1.883235e-10 4.08794e-10 3.099932e-10 ] [ 4.668223000000001e-10 1.307552e-10 1.415877e-10 ] [ 3.293332e-10 1.297731e-10 3.803317e-10 ] [ 4.485506e-10 3.146522e-10 2.925064e-10 ] [ 3.343094e-10 3.696236e-10 5.003524e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.7191717 0.7739574 -18.1600166 ] [ -9.2821346 -2.9712314 1.9785425 ] [ -5.8047799 8.7996202 2.6023906 ] [ 1.2047364 -2.6623073 -0.8233084 ] [ 5.1749517 -13.1370256 8.4652867 ] [ 13.5553294 6.4964204 0.4168862 ] [ -0.1289313 2.7005663 5.5202191 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.560946567280992e-09 1.240016451775154e-09 -2.90955540298599e-08 ] [ -1.487161904723876e-08 -4.760437484066854e-09 3.169974536759184e-09 ] [ -9.300282644669761e-09 1.409854575635942e-08 4.169489377509684e-09 ] [ 1.930200494306757e-09 -4.265486513445172e-09 -1.319085470188255e-09 ] [ 8.291186627509216e-09 -2.104783528317109e-08 1.356288443910918e-08 ] [ 2.171803185192289e-08 1.040841288376818e-08 6.679253231741529e-10 ] [ -2.06570714549351e-10 4.32678418878036e-09 8.844365983713618e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 6.9500525 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.113521162883259e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5916331 1.9083544 0.7199265 ] [ 1.1672528 1.2800231 3.3644764 ] [ 2.2417552 4.1500454 3.3412214 ] [ 4.4291488 1.9033429 1.0325342 ] [ 2.2854692 0.2547246 4.4468577 ] [ 5.1689409 4.217942 3.3627211 ] [ 3.684425 4.2899576 4.9980857 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5916331e-10 1.9083544e-10 7.199265e-11 ] [ 1.1672528e-10 1.2800231e-10 3.3644764e-10 ] [ 2.2417552e-10 4.1500454e-10 3.3412214e-10 ] [ 4.4291488e-10 1.9033429e-10 1.0325342e-10 ] [ 2.2854692e-10 2.547246e-11 4.4468577e-10 ] [ 5.1689409e-10 4.217942e-10 3.3627211e-10 ] [ 3.684425e-10 4.289957600000001e-10 4.9980857e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0335543 -0.0164827 0.0182478 ] [ -0.1274776 0.0940635 -0.0327768 ] [ -0.0267554 -0.0619678 -0.0272884 ] [ 0.0552902 0.0072046 -0.0202389 ] [ 0.0205731 -0.1536006 0.0501541 ] [ 0.1064369 0.1036257 -0.016993 ] [ 0.0054871 0.0271572 0.0288952 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.375991498730945e-11 -2.640819658766016e-11 2.923619854103425e-11 ] [ -2.042416303956941e-10 1.507063405706208e-10 -5.251422266463745e-11 ] [ -4.286687636015232e-11 -9.928336040241026e-11 -4.372083649903872e-11 ] [ 8.858466579935616e-11 1.154304168221568e-11 -3.242629241070912e-11 ] [ 3.296173983738048e-11 -2.460952902608525e-10 8.035572645726528e-11 ] [ 1.705307127704275e-10 1.660266738540346e-10 -2.72257873172544e-11 ] [ 8.79130333599168e-12 4.351063092638976e-11 4.629521389334017e-11 ] ] } "relaxed-potential-energy" { "source-value" -29.889932 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.788895024770179e-18 } }