{ "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" [ [ 2.872972 1.012553 2.780557 ] [ 2.489863 2.81954 0.4602746 ] [ 1.064652 2.650766 2.601591 ] [ 2.280466 2.401905 4.700098 ] [ 2.677321 4.010574 3.508674 ] [ 4.446125 3.093023 2.174548 ] [ 4.337554 1.939772 4.152011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872972e-10 1.012553e-10 2.780557e-10 ] [ 2.489863e-10 2.81954e-10 4.602746e-11 ] [ 1.064652e-10 2.650766e-10 2.601591e-10 ] [ 2.280466e-10 2.401905e-10 4.700098e-10 ] [ 2.677321e-10 4.010574e-10 3.508674e-10 ] [ 4.446125000000001e-10 3.093023e-10 2.174548e-10 ] [ 4.337554e-10 1.939772e-10 4.152011e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0426067 -1.1274128 -1.9499984 ] [ 0.5098935 -0.5647753 3.1496087 ] [ 0.2368729 -0.2213139 -1.6523816 ] [ -2.0536149 -1.9165471 2.6559143 ] [ 0.6875367 3.8745511 -1.5974278 ] [ -0.9426996 0.3901778 -1.4427987 ] [ 2.6046181 -0.4346798 0.8370834 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.670440093191848e-09 -1.806314445032515e-09 -3.124241872817385e-09 ] [ 8.169394515284789e-10 -9.0486978912034e-10 5.046229465383116e-09 ] [ 3.795122256078186e-10 -3.545839593594126e-10 -2.647407189971534e-09 ] [ -3.290253808014246e-09 -3.070646981580461e-09 4.255243833366466e-09 ] [ 1.101555235757468e-09 6.207715239658997e-09 -2.559361495662025e-09 ] [ -1.510371272001146e-09 6.251337542655252e-10 -2.311618364705575e-09 ] [ 4.173058260313475e-09 -6.964338188317932e-10 1.341155464189275e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.59706 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.300012826109604e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6541218 0.6740561 2.4129819 ] [ 2.8235729 2.4960588 0.948116 ] [ 1.1487759 2.5591916 2.7082442 ] [ 2.371516 2.6256063 4.8076538 ] [ 2.540944 4.4476203 3.3427979 ] [ 4.4002763 3.4797084 2.3418098 ] [ 4.229746 1.6458915 3.81615 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6541218e-10 6.740561e-11 2.4129819e-10 ] [ 2.8235729e-10 2.4960588e-10 9.48116e-11 ] [ 1.1487759e-10 2.5591916e-10 2.7082442e-10 ] [ 2.371516e-10 2.6256063e-10 4.8076538e-10 ] [ 2.540944e-10 4.4476203e-10 3.3427979e-10 ] [ 4.4002763e-10 3.4797084e-10 2.3418098e-10 ] [ 4.229746e-10 1.6458915e-10 3.81615e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4e-07 -6.9e-06 -3.9e-06 ] [ -7.8e-06 3.9e-06 -1.72e-05 ] [ 7.7e-06 -4.3e-06 1.16e-05 ] [ -1.4e-05 -1.5e-06 -4.3e-06 ] [ 1.11e-05 -8e-07 6.6e-06 ] [ 2.7e-06 -8e-07 -5.9e-06 ] [ -2e-07 1.04e-05 1.29e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.408706536e-16 -1.10550187746e-14 -6.248488872599999e-15 ] [ -1.24969777452e-14 6.248488872599999e-15 -2.75574381048e-14 ] [ 1.23367600818e-14 -6.8893595262e-15 1.85852489544e-14 ] [ -2.243047287599999e-14 -2.403264951e-15 -6.8893595262e-15 ] [ 1.77841606374e-14 -1.2817413072e-15 1.05743657844e-14 ] [ 4.3258769118e-15 -1.2817413072e-15 -9.452842140600001e-15 ] [ -3.204353268e-16 1.66626369936e-14 2.06680785786e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.96247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.678993289292598e-18 } }