{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.271696 2.59158 0.2830491 ] [ 1.885666 2.994299 3.04756 ] [ 2.618377 0.6246748 1.626494 ] [ 2.195128 4.700519 1.092758 ] [ 3.86025 2.803257 1.694059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.271696e-10 2.59158e-10 2.830491e-11 ] [ 1.885666e-10 2.994299e-10 3.04756e-10 ] [ 2.618377e-10 6.246748e-11 1.626494e-10 ] [ 2.195128e-10 4.700519e-10 1.092758e-10 ] [ 3.86025e-10 2.803257e-10 1.694059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6818997 -2.6476346 -1.2122363 ] [ 1.5256926 1.7813283 -1.7460786 ] [ 1.1120728 3.8215985 -1.10038 ] [ 1.5588292 -3.0195933 2.8377999 ] [ -3.5146949 0.0643011 1.2208951 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.09252376607161e-09 -4.241978291489936e-09 -1.942216674746614e-09 ] [ 2.444429034386708e-09 2.854002579742942e-09 -2.797526334047432e-09 ] [ 1.781737055466955e-09 6.122875821229449e-09 -1.76300312452092e-09 ] [ 2.497519720636912e-09 -4.837921829442952e-09 4.546656691747537e-09 ] [ -5.631162044418966e-09 1.030217199604974e-10 1.956089601785093e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.744402046368851 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.401007663699396e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9691841 2.5212144 0.2665907 ] [ 1.7605668 2.8413419 2.7190231 ] [ 2.697189 0.974965 1.7811638 ] [ 2.4256673 4.5073685 1.296977 ] [ 3.9785098 2.8694399 1.6801655 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9691841e-10 2.5212144e-10 2.665907e-11 ] [ 1.7605668e-10 2.8413419e-10 2.7190231e-10 ] [ 2.697189e-10 9.74965e-11 1.7811638e-10 ] [ 2.4256673e-10 4.5073685e-10 1.296977e-10 ] [ 3.9785098e-10 2.8694399e-10 1.6801655e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.61e-05 0.0001708 -6.43e-05 ] [ 0.0002177 6.7e-05 -2.47e-05 ] [ 7.67e-05 6.08e-05 -3.17e-05 ] [ -6.99e-05 -0.0002149 -0.0001016 ] [ -0.0001384 -8.37e-05 0.0002223 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.379474081874e-13 2.736517690872e-13 -1.030199575662e-13 ] [ 3.487938532218e-13 1.07345834478e-13 -3.95737628598e-14 ] [ 1.228869478278e-13 9.741233934719999e-14 -5.078899929779999e-14 ] [ -1.119921467166e-13 -3.443077586466e-13 -1.627811460144e-13 ] [ -2.217412461456e-13 -1.341021842658e-13 3.561638657382e-13 ] ] } "relaxed-potential-energy" { "source-value" -12.924216046368851 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.070687696226003e-18 } }