{ "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" [ [ 2.625679 2.727046 1.588106 ] [ 1.116882 2.069952 3.236218 ] [ 3.070568 3.395161 4.858531 ] [ 1.593326 4.342716 3.66284 ] [ 4.916804 2.207526 1.823276 ] [ 3.525085 1.533636 3.413768 ] [ 3.625469 4.392152 2.422621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.625679e-10 2.727046e-10 1.588106e-10 ] [ 1.116882e-10 2.069952e-10 3.236218e-10 ] [ 3.070568e-10 3.395161e-10 4.858531e-10 ] [ 1.593326e-10 4.342716e-10 3.66284e-10 ] [ 4.916804e-10 2.207526e-10 1.823276e-10 ] [ 3.525085e-10 1.533636e-10 3.413768e-10 ] [ 3.625469e-10 4.392152e-10 2.422621e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1481071 -1.7267808 -2.3516334 ] [ 0.7890615 0.0153051 0.4489386 ] [ 1.7870442 -1.388222 0.3910468 ] [ -1.7575247 0.9852524 -1.4475889 ] [ 0.7643827 0.8051492 -0.5473514 ] [ -1.1080655 -0.511283 1.905234 ] [ 1.6732089 1.8205791 1.6013543 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.441646974594488e-09 -2.766607827006321e-09 -3.767732054172415e-09 ] [ 1.264215887673379e-09 2.452147339900608e-11 7.19278929094683e-10 ] [ 2.863160437576239e-09 -2.224176832880218e-09 6.265260405986535e-10 ] [ -2.815864984818534e-09 1.57854836086709e-09 -2.319293092109589e-09 ] [ 1.22467609128398e-09 1.289991224495823e-09 -8.769536164421492e-10 ] [ -1.775316638415062e-09 -8.191656692124865e-10 3.052521371953267e-09 ] [ 2.680776181294485e-09 2.916889270337105e-09 2.565652421077549e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.027548085572459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.286154986505199e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4800745 2.7305748 1.6461172 ] [ 1.2968497 2.1161558 3.6723634 ] [ 3.3695873 3.1746216 4.3554135 ] [ 1.5766721 4.3445176 3.2152621 ] [ 4.7641936 2.6092965 2.4531538 ] [ 3.2668374 1.0437266 3.2013185 ] [ 3.7195984 4.6492962 2.4617316 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4800745e-10 2.7305748e-10 1.6461172e-10 ] [ 1.2968497e-10 2.1161558e-10 3.6723634e-10 ] [ 3.3695873e-10 3.1746216e-10 4.3554135e-10 ] [ 1.5766721e-10 4.3445176e-10 3.2152621e-10 ] [ 4.764193599999999e-10 2.6092965e-10 2.4531538e-10 ] [ 3.2668374e-10 1.0437266e-10 3.2013185e-10 ] [ 3.7195984e-10 4.6492962e-10 2.4617316e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.1e-06 6.9e-06 -4e-06 ] [ 7.6e-06 2.7e-06 -2.46e-05 ] [ 4.2e-06 -9e-07 1.26e-05 ] [ -2.77e-05 7.2e-06 -7e-07 ] [ -1.46e-05 2.4e-05 -3.76e-05 ] [ 5.8e-06 -1.49e-05 3.83e-05 ] [ 2.97e-05 -2.5e-05 1.6e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.17110076608e-15 1.105501868352e-14 -6.4087064832e-15 ] [ 1.217654231808e-14 4.32587687616e-15 -3.941354487168e-14 ] [ 6.72914180736e-15 -1.44195895872e-15 2.018742542208e-14 ] [ -4.438029239616e-14 1.153567166976e-14 -1.12152363456e-15 ] [ -2.339177866368e-14 3.84522388992e-14 -6.024184094208e-14 ] [ 9.292624400640001e-15 -2.387243164992e-14 6.136336457664001e-14 ] [ 4.758464563776e-14 -4.005441552e-14 2.56348259328e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.821491085572458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.573576339869981e-18 } }