{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.7722933e-10 1.9962649e-10 3.0144074e-10 ] [ 2.2897481e-10 1.404889e-10 5.4128553e-10 ] [ 3.0338988e-10 4.561796700000001e-10 3.0159718e-10 ] [ 1.3278806e-10 3.5055924e-10 4.5056341e-10 ] [ 4.6731884e-10 1.2460473e-10 1.693356e-10 ] [ 3.644231e-10 3.2898523e-10 1.0539228e-10 ] [ 3.8039158e-10 3.2980144e-10 5.0127722e-10 ] ] "source-value" [ [ 2.7722933 1.9962649 3.0144074 ] [ 2.2897481 1.404889 5.4128553 ] [ 3.0338988 4.5617967 3.0159718 ] [ 1.3278806 3.5055924 4.5056341 ] [ 4.6731884 1.2460473 1.693356 ] [ 3.644231 3.2898523 1.0539228 ] [ 3.8039158 3.2980144 5.0127722 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -5.27244282372864e-12 4.00768459926912e-12 2.22750615589824e-12 ] [ 3.44612169367872e-12 3.4542927944448e-12 -2.43002128076736e-12 ] [ 6.26322884603136e-12 -4.61955585075264e-12 -4.7007862054272e-13 ] [ 1.59272377873728e-12 3.689812757702399e-13 4.03492160182272e-12 ] [ 7.885753109915521e-12 -1.0406137152096e-12 -2.69389977021312e-12 ] [ -4.25810480510016e-12 -4.0422916142784e-13 8.116626760972799e-13 ] [ -9.657440017196162e-12 -1.766399724432e-12 -1.48025097995712e-12 ] ] "source-value" [ [ -0.0032908 0.0025014 0.0013903 ] [ 0.0021509 0.002156 -0.0015167 ] [ 0.0039092 -0.0028833 -0.0002934 ] [ 0.0009941 0.0002303 0.0025184 ] [ 0.0049219 -0.0006495 -0.0016814 ] [ -0.0026577 -0.0002523 0.0005066 ] [ -0.0060277 -0.0011025 -0.0009239 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.338507335283474e-18 "source-value" -20.837324 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.648397793964738e-09 -2.96926458428872e-09 -6.846738847626465e-09 ] [ -9.839630249889136e-09 -1.518961762097618e-08 6.780676779674005e-09 ] [ -6.582228619939123e-10 4.154886819352389e-09 -2.153846406192284e-09 ] [ -3.325896282665833e-09 1.200343995161552e-09 -1.017965026062647e-09 ] [ 1.810113351136245e-09 -1.78751224663493e-09 -3.963703248851539e-10 ] [ -7.067888408119123e-10 1.222485274972698e-09 4.972021889915674e-10 ] [ 1.536882283840695e-08 1.336867852263086e-08 3.137041636100978e-09 ] ] "source-value" [ [ -1.6529999 -1.8532692 -4.2733983 ] [ -6.1414142 -9.4806137 4.2321656 ] [ -0.4108304 2.5932764 -1.3443252 ] [ -2.0758612 0.7491958 -0.6353638 ] [ 1.1297839 -1.1156774 -0.2473949 ] [ -0.4411429 0.7630153 0.3103292 ] [ 9.5924648 8.3440729 1.9579874 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.823259831011836e-18 "source-value" -17.621402 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.750115e-10 2.05781e-10 3.008489e-10 ] [ 2.459373e-10 1.512643e-10 5.182306e-10 ] [ 3.045421e-10 4.403069e-10 3.012822e-10 ] [ 1.351279e-10 3.64529e-10 4.777489e-10 ] [ 4.685264e-10 1.369475e-10 1.888704e-10 ] [ 3.677702e-10 3.202643e-10 9.471066000000001e-11 ] [ 3.576002e-10 3.111527e-10 4.892003e-10 ] ] "source-value" [ [ 2.750115 2.05781 3.008489 ] [ 2.459373 1.512643 5.182306 ] [ 3.045421 4.403069 3.012822 ] [ 1.351279 3.64529 4.777489 ] [ 4.685264 1.369475 1.888704 ] [ 3.677702 3.202643 0.9471066 ] [ 3.576002 3.111527 4.892003 ] ] } "instance-id" 1 }