{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.396346 1.355978 3.097514 ] [ 1.884272 1.266952 5.391976 ] [ 2.390434 4.172173 2.083104 ] [ 1.306064 3.125616 3.893724 ] [ 3.942091 2.333761 1.80322 ] [ 3.489943 3.083092 4.017618 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.396346e-10 1.355978e-10 3.097514e-10 ] [ 1.884272e-10 1.266952e-10 5.391976e-10 ] [ 2.390434e-10 4.172173e-10 2.083104e-10 ] [ 1.306064e-10 3.125616e-10 3.893724e-10 ] [ 3.942091e-10 2.333761e-10 1.80322e-10 ] [ 3.489943e-10 3.083092e-10 4.017618e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1805464 2.8233049 2.6444836 ] [ 1.4231451 4.8626836 -7.149975 ] [ 2.5620128 -7.8244723 5.8649241 ] [ 1.4059622 -1.7421251 -0.8899248 ] [ -4.34783 3.7582718 4.8738818 ] [ -1.2238365 -1.8776629 -5.3433896 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.892672210496051e-10 4.523433104170081e-09 4.236929798009019e-09 ] [ 2.280129807226078e-09 7.790877978267579e-09 -1.145552278430448e-08 ] [ 4.104797010350346e-09 -1.25361865891572e-08 9.396644275786482e-09 ] [ 2.252599766568534e-09 -2.791192105728862e-09 -1.425816708830116e-09 ] [ -6.965991577212864e-09 6.021415212571934e-09 7.808819472502622e-09 ] [ -1.960802227981699e-09 -3.008347600123529e-09 -8.561053892945864e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -31.833601 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.10030512780755e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1782995 1.5823533 2.8643937 ] [ 2.2057449 1.4975848 5.0711556 ] [ 2.3363005 3.6944924 2.2131894 ] [ 1.1943009 3.1822481 4.0400858 ] [ 4.0889779 2.342313 2.0584791 ] [ 3.4055264 3.0385804 4.0398523 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1782995e-10 1.5823533e-10 2.8643937e-10 ] [ 2.2057449e-10 1.4975848e-10 5.0711556e-10 ] [ 2.3363005e-10 3.6944924e-10 2.2131894e-10 ] [ 1.1943009e-10 3.1822481e-10 4.0400858e-10 ] [ 4.0889779e-10 2.342313e-10 2.0584791e-10 ] [ 3.4055264e-10 3.0385804e-10 4.0398523e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0001034 3.6e-05 8.15e-05 ] [ 2.71e-05 2.58e-05 -0.0001427 ] [ -0.0001044 1.61e-05 8.09e-05 ] [ 6.85e-05 -6.83e-05 -8.9e-05 ] [ 5.13e-05 -6.48e-05 8.35e-05 ] [ 6.09e-05 5.53e-05 -1.42e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6566506259072e-13 5.76783583488e-14 1.305773945952e-13 ] [ 4.341898642368e-14 4.133615681664e-14 -2.2863060378816e-13 ] [ -1.6726723921152e-13 2.579504359488e-14 1.2961608862272e-13 ] [ 1.097490985248e-13 -1.0942866320064e-13 -1.425937192512e-13 ] [ 8.219166064704e-14 -1.0382104502784e-13 1.337817478368e-13 ] [ 9.757255620672e-14 8.860036713024e-14 -2.275090801536e-14 ] ] } "relaxed-potential-energy" { "source-value" -39.006818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.249581185140063e-18 } }