{ "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" [ [ 2.10043 2.130682 2.453785 ] [ 1.948071 1.785129 4.606922 ] [ 2.343053 4.336787 1.957735 ] [ 4.413531 1.079857 2.965455 ] [ 3.524463 3.435576 3.796327 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.10043e-10 2.130682e-10 2.453785e-10 ] [ 1.948071e-10 1.785129e-10 4.606922e-10 ] [ 2.343053e-10 4.336787e-10 1.957735e-10 ] [ 4.413531e-10 1.079857e-10 2.965455e-10 ] [ 3.524463e-10 3.435576e-10 3.796327e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3237448 -7.615169 -6.3425346 ] [ -2.1687413 -2.3890757 4.2774748 ] [ -1.0587382 4.0287965 -2.8185442 ] [ -3.6648818 4.9942267 0.8261816 ] [ 9.2161062 0.9812215 4.0574225 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.723049591265572e-09 -1.220084573524092e-08 -1.016186065273508e-08 ] [ -3.474706607423399e-09 -3.827721231861394e-09 6.853270120621156e-09 ] [ -1.696285591587875e-09 6.454843562260868e-09 -4.515805621931439e-09 ] [ -5.871787937955421e-09 8.001633257715134e-09 1.323688844055137e-09 ] [ 1.476582988844993e-08 1.572090147126307e-09 6.500707470207889e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.512044 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.164868099602091e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.090635 1.8250128 2.3581214 ] [ 1.6963729 2.052701 4.7498675 ] [ 2.4342366 4.2164375 2.0569174 ] [ 4.4671535 1.3915475 2.6614382 ] [ 3.64115 3.2823322 3.9538794 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.090635e-10 1.8250128e-10 2.3581214e-10 ] [ 1.6963729e-10 2.052701e-10 4.7498675e-10 ] [ 2.4342366e-10 4.2164375e-10 2.0569174e-10 ] [ 4.467153500000001e-10 1.3915475e-10 2.6614382e-10 ] [ 3.64115e-10 3.2823322e-10 3.9538794e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.96e-05 4.05e-05 1e-05 ] [ -2.17e-05 3.17e-05 1.51e-05 ] [ -2.06e-05 -3.17e-05 -1.83e-05 ] [ 2.11e-05 3.04e-05 -1.67e-05 ] [ 1.7e-06 -7.09e-05 9.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.140266176767999e-14 6.488815314240001e-14 1.6021766208e-14 ] [ -3.476723267136e-14 5.078899887936e-14 2.419286697408e-14 ] [ -3.300483838848e-14 -5.078899887936e-14 -2.931983216064e-14 ] [ 3.380592669888e-14 4.870616927232e-14 -2.675634956736e-14 ] [ 2.72370025536e-15 -1.1359432241472e-13 1.586154854592e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.079847 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.576275492944102e-18 } }