{ "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" [ [ 0.1126891 1.464287 0.6414025 ] [ 1.365449 0.1265984 2.502806 ] [ 0.3364486 2.37729 2.80341 ] [ 2.851665 1.424041 0.0715282 ] [ 2.597469 0.5436052 1.609588 ] [ 2.328633 2.330176 2.375244 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.126891e-11 1.464287e-10 6.414025e-11 ] [ 1.365449e-10 1.265984e-11 2.502806e-10 ] [ 3.364486e-11 2.37729e-10 2.80341e-10 ] [ 2.851665e-10 1.424041e-10 7.15282e-12 ] [ 2.597469e-10 5.436052e-11 1.609588e-10 ] [ 2.328633e-10 2.330176e-10 2.375244e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.5372304 -1.7152034 0.6620647 ] [ -19.6473049 -4.0268184 13.0052673 ] [ -3.611324 -1.5902891 1.795937 ] [ 2.7047636 7.4562516 -13.478073 ] [ 14.6142757 -8.8545842 -4.6545133 ] [ 3.4023591 8.7306435 2.6693173 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.065091261954473e-09 -2.748058810037355e-09 1.060744592536219e-09 ] [ -3.147845283185371e-08 -6.451674349841264e-09 2.083673538698427e-08 ] [ -5.785978930603416e-09 -2.547924037324889e-09 2.877408297536057e-09 ] [ 4.333509040413722e-09 1.194623209074511e-08 -2.159425363194628e-08 ] [ 2.341465104937399e-08 -1.418660790902558e-08 -7.457352451902232e-09 ] [ 5.451180250497269e-09 1.398803301548398e-08 4.276717806791968e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.36522505564262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.789508318301955e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.1594247 2.1030453 0.9352032 ] [ 1.1621103 0.2849118 1.6335258 ] [ 0.3984317 1.8078202 3.257305 ] [ 2.7987145 0.9476467 0.077206 ] [ 3.3570657 0.6522056 2.3991602 ] [ 2.0354562 2.4703679 1.7015783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.594247e-11 2.1030453e-10 9.352032000000001e-11 ] [ 1.1621103e-10 2.849118e-11 1.6335258e-10 ] [ 3.984317e-11 1.8078202e-10 3.257305e-10 ] [ 2.7987145e-10 9.476467e-11 7.7206e-12 ] [ 3.3570657e-10 6.522056000000001e-11 2.3991602e-10 ] [ 2.0354562e-10 2.4703679e-10 1.7015783e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0003123 0.0001781 0.0001044 ] [ -0.0004076 -0.000421 -0.0001474 ] [ 0.000173 -6.56e-05 6.2e-06 ] [ 0.000325 -9.98e-05 -8.64e-05 ] [ 0.0002261 -1.76e-05 0.0002592 ] [ -4.4e-06 0.0004258 -0.0001361 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.003597627982e-13 2.853476585154e-13 1.672672405896e-13 ] [ -6.530471960184e-13 -6.745163629139998e-13 -2.361608358516e-13 ] [ 2.77176557682e-13 -1.051027871904e-13 9.9334951308e-15 ] [ 5.207074060499999e-13 -1.598972280732e-13 -1.384280611776e-13 ] [ 3.622521369474e-13 -2.81983087584e-14 4.152841835328e-13 ] [ -7.0495771896e-15 6.822068107572e-13 -2.180562398874e-13 ] ] } "relaxed-potential-energy" { "source-value" -16.207209055642622 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.596681165130381e-18 } }