{ "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" [ [ 1.180338 1.724614 2.454285 ] [ 2.279675 2.151595 5.035575 ] [ 1.206438 3.673046 1.250197 ] [ 2.791298 3.409437 3.168578 ] [ 3.407643 1.775427 1.527211 ] [ 3.723971 4.511514 1.482617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.180338e-10 1.724614e-10 2.454285e-10 ] [ 2.279675e-10 2.151595e-10 5.035575e-10 ] [ 1.206438e-10 3.673046e-10 1.250197e-10 ] [ 2.791298e-10 3.409437e-10 3.168578e-10 ] [ 3.407643e-10 1.775427e-10 1.527211e-10 ] [ 3.723971e-10 4.511514e-10 1.482617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0587919 -2.1447237 7.8167554 ] [ -3.2539424 -1.8365902 -6.2226038 ] [ 4.4143842 -2.0329457 -1.6526414 ] [ 1.3081204 2.0540536 4.7877712 ] [ -2.6925316 4.9663398 -2.389622 ] [ 0.1651775 -1.0061339 -2.3396594 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.419500767241152e-11 -3.436226170215673e-09 1.252382275239215e-08 ] [ -5.213390438709842e-09 -2.942541880430396e-09 -9.96971032886124e-09 ] [ 7.072623160468912e-09 -3.257138071895891e-09 -2.647823413646181e-09 ] [ 2.095839922071544e-09 3.290956655790075e-09 7.67085508237956e-09 ] [ -4.313911180285218e-09 7.956953518508548e-09 -3.828596500949337e-09 ] [ 2.64643528782192e-10 -1.612004211974325e-09 -3.748547591314956e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.723753 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.679440606863386e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3357551 1.5326202 2.693458 ] [ 1.828484 2.0477415 4.9466246 ] [ 1.3515461 3.6569652 1.427498 ] [ 2.9753697 3.5025425 3.3833671 ] [ 3.3688417 1.9997283 1.3652492 ] [ 3.7293665 4.5060353 1.1022661 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3357551e-10 1.5326202e-10 2.693458e-10 ] [ 1.828484e-10 2.0477415e-10 4.9466246e-10 ] [ 1.3515461e-10 3.6569652e-10 1.427498e-10 ] [ 2.9753697e-10 3.5025425e-10 3.3833671e-10 ] [ 3.3688417e-10 1.9997283e-10 1.3652492e-10 ] [ 3.7293665e-10 4.5060353e-10 1.1022661e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.03e-05 -7.1e-06 1.82e-05 ] [ -1.02e-05 -4.8e-06 1.27e-05 ] [ 4.8e-06 4.84e-05 1.89e-05 ] [ -2.83e-05 -2.94e-05 -9.64e-05 ] [ 7.9e-06 -1.63e-05 3.22e-05 ] [ -4.7e-06 9.3e-06 1.44e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.854595161024e-14 -1.137545400768e-14 2.915961449856e-14 ] [ -1.634220153216e-14 -7.69044777984e-15 2.034764308416e-14 ] [ 7.69044777984e-15 7.754534844671999e-14 3.028113813312e-14 ] [ -4.534159836864e-14 -4.710399265152e-14 -1.5444982624512e-13 ] [ 1.265719530432e-14 -2.611547891904e-14 5.159008718975999e-14 ] [ -7.53023011776e-15 1.490024257344e-14 2.307134333952e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.309927 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.254009020955468e-18 } }