{ "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" [ [ 1.248369 0.1750326 1.959235 ] [ 0.2041437 1.690187 0.8451771 ] [ 0.5672117 2.337944 2.235934 ] [ 2.305261 0.0188332 0.1900716 ] [ 2.629759 0.4646214 2.471997 ] [ 1.518408 2.931316 1.102854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.248369e-10 1.750326e-11 1.959235e-10 ] [ 2.041437e-11 1.690187e-10 8.451771e-11 ] [ 5.672117e-11 2.337944e-10 2.235934e-10 ] [ 2.305261e-10 1.88332e-12 1.900716e-11 ] [ 2.629759e-10 4.646214e-11 2.471997e-10 ] [ 1.518408e-10 2.931316e-10 1.102854e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -24.7944459 -12.731393 -4.5511114 ] [ -12.6447664 -7.1090762 -20.0144488 ] [ -7.6311383 4.7955709 29.1791347 ] [ 2.9887063 -3.0235346 -4.7917046 ] [ 28.8062334 2.6644171 12.6711498 ] [ 13.2754109 15.4040158 -12.4930198 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.972508154667041e-08 -2.039794021481678e-08 -7.291684283736357e-09 ] [ -2.025914910155738e-08 -1.138999568312571e-08 -3.206668194555861e-08 ] [ -1.222643137435146e-08 7.683351579368816e-09 4.675012743151402e-08 ] [ 4.788435360297671e-09 -4.84423644829988e-09 -7.677157083899816e-09 ] [ 4.61526736867881e-08 4.268866785679736e-09 2.03014199682146e-08 ] [ 2.126955297549349e-08 2.467995398119381e-08 -2.001602424675149e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.9398253 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.914472606496347e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.3688744 0.4079166 2.1186853 ] [ 0.5873938 1.052937 -0.0441501 ] [ 1.2888477 1.9487428 3.0600635 ] [ 2.7699691 0.1595445 0.20682 ] [ 3.2776677 0.8079297 2.4535083 ] [ 0.9181485 3.2408636 1.0103417 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.688744e-11 4.079166e-11 2.1186853e-10 ] [ 5.873938e-11 1.052937e-10 -4.41501e-12 ] [ 1.2888477e-10 1.9487428e-10 3.0600635e-10 ] [ 2.7699691e-10 1.595445e-11 2.0682e-11 ] [ 3.2776677e-10 8.079297e-11 2.4535083e-10 ] [ 9.181485000000001e-11 3.2408636e-10 1.0103417e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.54e-05 2.75e-05 6.9e-06 ] [ -1.47e-05 2.26e-05 5.49e-05 ] [ -3.31e-05 -2.04e-05 -6.21e-05 ] [ 9.1e-06 3.15e-05 6.7e-06 ] [ 2.8e-06 -2.89e-05 9e-06 ] [ 5e-07 -3.24e-05 -1.55e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.671705237632e-14 4.4059857072e-14 1.105501868352e-14 ] [ -2.355199632576e-14 3.620919163008e-14 8.795949648192e-14 ] [ -5.303204614848e-14 -3.268440306432e-14 -9.949516815168001e-14 ] [ 1.457980724928e-14 5.04685635552e-14 1.073458335936e-14 ] [ 4.48609453824e-15 -4.630290434112001e-14 1.44195895872e-14 ] [ 8.010883104e-16 -5.191052251392001e-14 -2.48337376224e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.186062 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.753510674001929e-18 } }