{ "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" [ [ 2.04098 2.133134 3.812884 ] [ 2.161605 4.797503 2.926814 ] [ 2.748178 3.149118 1.513672 ] [ 4.833213 2.247647 2.725743 ] [ 4.087134 1.710162 4.852625 ] [ 4.720686 4.556589 2.507622 ] [ 3.429181 3.830938 4.469304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04098e-10 2.133134e-10 3.812884e-10 ] [ 2.161605e-10 4.797503e-10 2.926814e-10 ] [ 2.748178e-10 3.149118e-10 1.513672e-10 ] [ 4.833213e-10 2.247647e-10 2.725743e-10 ] [ 4.087134e-10 1.710162e-10 4.852625e-10 ] [ 4.720686e-10 4.556589e-10 2.507622e-10 ] [ 3.429181e-10 3.830938e-10 4.469304000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.1135207 -3.9588048 -2.3679949 ] [ -5.2670913 3.7736161 -0.472799 ] [ -1.016428 -3.6894476 -3.2467463 ] [ 3.9663589 -4.7230848 -3.3091196 ] [ 3.3261887 -3.4206988 0.5242754 ] [ 4.2257948 2.3763548 0.0552684 ] [ 1.8786976 9.642065 8.8171161 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.139711655711685e-08 -6.342704496870819e-09 -3.793946066953633e-09 ] [ -8.438810540479079e-09 6.045999491294475e-09 -7.575075041376193e-10 ] [ -1.628497178326503e-09 -5.911146688386669e-09 -5.201861015528903e-09 ] [ 6.354807499282005e-09 -7.567216044615843e-09 -5.301794058551048e-09 ] [ 5.329141771509145e-09 -5.480563644158615e-09 8.399817887405682e-10 ] [ 6.770469632858212e-09 3.80734010328586e-09 8.854973834902272e-11 ] [ 3.01000537227307e-09 1.544829111923395e-08 1.412657727829927e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.330643 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.815369131323118e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5687913 1.7257695 3.7087858 ] [ 2.1758994 4.6220842 2.94932 ] [ 2.5956273 2.6700035 1.5493423 ] [ 4.852561 2.3151303 2.3520685 ] [ 3.8990028 1.9616878 4.6247995 ] [ 5.2215706 4.7629469 2.7917459 ] [ 3.7075246 4.3674688 4.8326021 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5687913e-10 1.7257695e-10 3.7087858e-10 ] [ 2.1758994e-10 4.6220842e-10 2.949320000000001e-10 ] [ 2.5956273e-10 2.6700035e-10 1.5493423e-10 ] [ 4.852561e-10 2.3151303e-10 2.3520685e-10 ] [ 3.8990028e-10 1.9616878e-10 4.6247995e-10 ] [ 5.2215706e-10 4.7629469e-10 2.7917459e-10 ] [ 3.7075246e-10 4.3674688e-10 4.8326021e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0062208 0.0173633 0.0147195 ] [ -0.0370629 -0.0058205 0.0481248 ] [ 0.0102836 -0.0198492 -0.0502542 ] [ -0.0025452 0.0039834 0.0029434 ] [ -0.0068581 0.0054376 0.0001026 ] [ 0.0240303 -0.0076299 0.0222346 ] [ 0.0059315 0.0065152 -0.0378709 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.96682032267264e-12 2.781907331993664e-11 2.35832387698656e-11 ] [ -5.938131187904833e-11 -9.325469021366402e-12 7.710442944067585e-11 ] [ 1.647614349765888e-11 -3.180192418158336e-11 -8.051610433700735e-11 ] [ -4.07785993526016e-12 6.38211035129472e-12 4.715846665662721e-12 ] [ -1.098788748310848e-11 8.71199559326208e-12 1.6438332129408e-13 ] [ 3.850078485081024e-11 -1.222444739904192e-11 3.562375629283968e-11 ] [ 9.503310626275201e-12 1.043850111983616e-11 -6.067587058865472e-11 ] ] } "relaxed-potential-energy" { "source-value" -18.714245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.99835258149233e-18 } }