{ "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" [ [ 2.719922 0.6324479 2.001085 ] [ 1.570016 2.535953 2.950979 ] [ 1.512501 2.471908 5.050939 ] [ 3.556391 2.380181 1.668166 ] [ 3.168972 1.023761 5.396195 ] [ 4.64835 1.331065 3.67677 ] [ 3.603196 3.529371 4.833641 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.719922e-10 6.324478999999999e-11 2.001085e-10 ] [ 1.570016e-10 2.535953e-10 2.950979e-10 ] [ 1.512501e-10 2.471908e-10 5.050939e-10 ] [ 3.556391e-10 2.380181e-10 1.668166e-10 ] [ 3.168972e-10 1.023761e-10 5.396195e-10 ] [ 4.64835e-10 1.331065e-10 3.67677e-10 ] [ 3.603196e-10 3.529371e-10 4.833641e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2637545 -10.223969 -0.3198105 ] [ -6.4225004 2.7607542 -3.6012778 ] [ -4.0593425 0.5727669 3.7760379 ] [ 5.8121322 7.9433367 -3.5107955 ] [ 0.9074545 -5.4352119 3.190895 ] [ 3.401703 -0.4894631 0.1361877 ] [ 3.6243077 4.8717862 0.3287631 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.229111155930794e-09 -1.638060410358396e-08 -5.123929061863584e-10 ] [ -1.028997998795865e-08 4.423215835015408e-09 -5.769883096166058e-09 ] [ -6.503783649319824e-09 9.176737363480915e-10 6.049879642634728e-09 ] [ 9.31206232783887e-09 1.272662835188262e-08 -5.624914470509846e-09 ] [ 1.453902384339754e-09 -8.708169435273946e-09 5.112377368427616e-09 ] [ 5.450129017505223e-09 -7.842063355642925e-10 2.181967489805241e-10 ] [ 5.80678106352542e-09 7.805461951176072e-09 5.267365526017324e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.705709 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.715243666888815e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7418254 0.196351 2.7310581 ] [ 1.4516962 2.2056449 2.524864 ] [ 1.8930171 2.6638514 4.8868364 ] [ 3.1463488 3.8080992 1.9743901 ] [ 2.6695866 0.4321835 5.3262816 ] [ 4.786529 1.1553468 3.9877542 ] [ 4.0903448 3.4432101 4.1465907 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7418254e-10 1.96351e-11 2.7310581e-10 ] [ 1.4516962e-10 2.2056449e-10 2.524864e-10 ] [ 1.8930171e-10 2.6638514e-10 4.8868364e-10 ] [ 3.1463488e-10 3.8080992e-10 1.9743901e-10 ] [ 2.6695866e-10 4.321835e-11 5.3262816e-10 ] [ 4.786529e-10 1.1553468e-10 3.9877542e-10 ] [ 4.0903448e-10 3.4432101e-10 4.1465907e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.9e-06 9.6e-06 3.3e-06 ] [ 1.72e-05 -3.6e-06 1.8e-05 ] [ -3.65e-05 -1.8e-06 -3.6e-06 ] [ 1.4e-06 9.1e-06 -9.7e-06 ] [ 9.1e-06 8.9e-06 9e-07 ] [ 5.1e-06 8e-06 -7.2e-06 ] [ 8.6e-06 -3.03e-05 -1.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.850665441919999e-15 1.538089555968e-14 5.28718284864e-15 ] [ 2.755743787776e-14 -5.76783583488e-15 2.88391791744e-14 ] [ -5.84794466592e-14 -2.88391791744e-15 -5.76783583488e-15 ] [ 2.24304726912e-15 1.457980724928e-14 -1.554111322176e-14 ] [ 1.457980724928e-14 1.425937192512e-14 1.44195895872e-15 ] [ 8.17110076608e-15 1.28174129664e-14 -1.153567166976e-14 ] [ 1.377871893888e-14 -4.854595161024e-14 -2.56348259328e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.875973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.864046601465204e-18 } }