{ "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" [ [ 2.336271 1.731327 1.289714 ] [ 2.769645 4.287083 1.737277 ] [ 4.480326 1.077167 0.108092 ] [ 5.392167 2.307543 2.197028 ] [ 3.12468 2.46702 3.187134 ] [ 4.416093 3.533887 0.3236582 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.336271e-10 1.731327e-10 1.289714e-10 ] [ 2.769645e-10 4.287083e-10 1.737277e-10 ] [ 4.480326e-10 1.077167e-10 1.08092e-11 ] [ 5.392167e-10 2.307543e-10 2.197028e-10 ] [ 3.12468e-10 2.467020000000001e-10 3.187134e-10 ] [ 4.416093e-10 3.533887e-10 3.236582e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2278617 -1.2859066 -2.5050198 ] [ -1.1327769 -0.4008656 0.0897941 ] [ -0.5698595 0.917893 1.2249134 ] [ -1.0744926 -0.5080455 -0.4732029 ] [ 2.0234263 0.7576839 2.7586046 ] [ 1.9815644 0.5192407 -1.0950894 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.967251309315743e-09 -2.060249491052417e-09 -4.013484158201092e-09 ] [ -1.8149086657623e-09 -6.422574924029645e-10 1.438660077057773e-10 ] [ -9.130155680407776e-10 1.470626704995974e-09 1.962527611984638e-09 ] [ -1.721526922942606e-09 -8.139786224026465e-10 -7.581546232747603e-10 ] [ 3.241886311771848e-09 1.213943430536565e-09 4.419771796151336e-09 ] [ 3.17481615428958e-09 8.319153101078266e-10 -1.7545266343659e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.3667 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.782452072044736e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2444157 1.6561057 1.3176479 ] [ 2.6477133 4.0270529 1.5070101 ] [ 4.2907185 1.3034526 0.1834171 ] [ 5.3439554 2.1960842 2.1631966 ] [ 3.2978011 2.5447783 3.298969 ] [ 4.6945781 3.6765533 0.3726625 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2444157e-10 1.6561057e-10 1.3176479e-10 ] [ 2.6477133e-10 4.0270529e-10 1.5070101e-10 ] [ 4.2907185e-10 1.3034526e-10 1.834171e-11 ] [ 5.3439554e-10 2.1960842e-10 2.1631966e-10 ] [ 3.2978011e-10 2.5447783e-10 3.298969e-10 ] [ 4.6945781e-10 3.6765533e-10 3.726625e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.69e-05 -3.6e-06 4.7e-06 ] [ 2e-06 -1.55e-05 -3.39e-05 ] [ -3.94e-05 -4.7e-06 -3.28e-05 ] [ -2.6e-06 -4.63e-05 7.84e-05 ] [ 2.14e-05 9.3e-06 1.41e-05 ] [ -1.82e-05 6.07e-05 -3.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.912031730752001e-14 -5.76783583488e-15 7.53023011776e-15 ] [ 3.2043532416e-15 -2.48337376224e-14 -5.431378744512e-14 ] [ -6.312575885952001e-14 -7.53023011776e-15 -5.255139316223999e-14 ] [ -4.16565921408e-15 -7.418077754303999e-14 1.2561064707072e-13 ] [ 3.428657968511999e-14 1.490024257344e-14 2.259069035328e-14 ] [ -2.915961449856e-14 9.725212088256e-14 -4.88663869344e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.446422 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.955442606581078e-18 } }