{ "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" [ [ -4.2834967 -2.4249865 0.8677543 ] [ -2.8499887 -1.2399929 2.7410523 ] [ -3.2745599 -2.3527222 -2.9688948 ] [ 1.5954496 0.4110365 0.7220236 ] [ 1.0430857 -1.3400124 -0.0303233 ] [ 6.105202 1.9415773 -1.1721883 ] [ 1.664308 5.0051001 -0.1594237 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.862918324556107e-09 -3.885256708065441e-09 1.390295663513026e-09 ] [ -4.566185302304035e-09 -1.986687650705899e-09 4.391649947631958e-09 ] [ -5.246423358413375e-09 -3.769476535133075e-09 -4.756693877364102e-09 ] [ 2.556192069844646e-09 6.58553076021141e-10 1.156809341116562e-09 ] [ 1.671207535799533e-09 -2.146936556550261e-09 -4.85832827257722e-11 ] [ 9.781611990250067e-09 3.110749783164808e-09 -1.878052704908182e-09 ] [ 2.666515389379272e-09 8.019054431051063e-09 -2.554249270458258e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.838891 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.178540760467289e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5504239 2.7422961 0.447634 ] [ 1.7681635 4.9389604 1.2775156 ] [ 2.1006428 3.0858384 2.8841743 ] [ 4.9064239 2.5354341 0.991378 ] [ 4.4845454 2.8576686 3.2767666 ] [ 4.0930863 4.7564401 0.448417 ] [ 3.6433092 5.0999863 2.8849532 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5504239e-10 2.7422961e-10 4.47634e-11 ] [ 1.7681635e-10 4.938960400000001e-10 1.2775156e-10 ] [ 2.1006428e-10 3.0858384e-10 2.884174300000001e-10 ] [ 4.906423900000001e-10 2.5354341e-10 9.91378e-11 ] [ 4.4845454e-10 2.8576686e-10 3.2767666e-10 ] [ 4.093086300000001e-10 4.7564401e-10 4.48417e-11 ] [ 3.6433092e-10 5.099986300000001e-10 2.8849532e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.76e-05 4.7e-06 1.44e-05 ] [ 3.37e-05 -9.5e-06 -2.27e-05 ] [ -4e-07 8.1e-06 -7.8e-06 ] [ 7.4e-06 3e-06 -4e-06 ] [ 1.12e-05 -4.6e-06 1.6e-06 ] [ -2.37e-05 2.2e-06 4.1e-06 ] [ -1.05e-05 -4e-06 1.44e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.81983087584e-14 7.530230179799999e-15 2.30713435296e-14 ] [ 5.399335256579999e-14 -1.5220678023e-14 -3.636940959179999e-14 ] [ -6.408706536e-16 1.29776307354e-14 -1.24969777452e-14 ] [ 1.18561070916e-14 4.806529901999999e-15 -6.408706535999999e-15 ] [ 1.79443783008e-14 -7.370012516399999e-15 2.5634826144e-15 ] [ -3.79715862258e-14 3.5247885948e-15 6.568924199399999e-15 ] [ -1.6822854657e-14 -6.408706535999999e-15 2.30713435296e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.563325 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.615043210034805e-18 } }