{ "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" [ [ 2.166449 2.681347 1.091002 ] [ 2.041583 4.789781 2.041915 ] [ 2.132392 3.124558 3.564623 ] [ 4.758388 2.994993 0.5845722 ] [ 4.303836 3.011562 3.07876 ] [ 3.921174 5.3024 1.134071 ] [ 3.577747 5.183138 3.725421 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.166449e-10 2.681347e-10 1.091002e-10 ] [ 2.041583e-10 4.789780999999999e-10 2.041915e-10 ] [ 2.132392e-10 3.124558e-10 3.564623e-10 ] [ 4.758388e-10 2.994993e-10 5.845722e-11 ] [ 4.303836000000001e-10 3.011562e-10 3.07876e-10 ] [ 3.921174e-10 5.3024e-10 1.134071e-10 ] [ 3.577747e-10 5.183138e-10 3.725421e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.6653361 1.1434468 1.6478654 ] [ -3.3148168 0.7864072 -0.1396998 ] [ -1.5859495 -0.9479961 1.0610458 ] [ -2.5292935 0.8568812 1.7674464 ] [ -0.4131419 1.8272899 -5.2271128 ] [ 2.5757661 -3.6427104 1.2663701 ] [ 0.6020995 -0.0233186 -0.3759152 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.474692427594251e-09 1.832003730088573e-09 2.64017141810524e-09 ] [ -5.31092197919507e-09 1.25996323026879e-09 -2.238237534904359e-10 ] [ -2.540971210669449e-09 -1.518857188029579e-09 1.699982774358033e-09 ] [ -4.052374912841405e-09 1.372875025443049e-09 2.831761300597125e-09 ] [ -6.619262932528915e-10 2.92764115720397e-09 -8.374757922444425e-09 ] [ 4.126832226069195e-09 -5.836265439225017e-09 2.028948567500158e-09 ] [ 9.646697422953696e-10 -3.736051574978688e-11 -6.022825448433562e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -26.069477 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.176790656588332e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5077423 2.9149158 1.2258554 ] [ 1.6590598 4.9990626 2.0980188 ] [ 2.1086647 3.1532129 3.5940348 ] [ 4.794182 2.8696639 0.4830236 ] [ 4.4017592 3.0548986 2.8480428 ] [ 3.9373828 4.9614353 1.3028289 ] [ 3.4927783 5.1345899 3.6685599 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5077423e-10 2.914915800000001e-10 1.2258554e-10 ] [ 1.6590598e-10 4.999062600000001e-10 2.0980188e-10 ] [ 2.1086647e-10 3.1532129e-10 3.5940348e-10 ] [ 4.794182e-10 2.8696639e-10 4.830236e-11 ] [ 4.4017592e-10 3.0548986e-10 2.8480428e-10 ] [ 3.9373828e-10 4.9614353e-10 1.3028289e-10 ] [ 3.4927783e-10 5.134589900000001e-10 3.6685599e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.82e-05 -2.38e-05 9.6e-06 ] [ 1.75e-05 -1.12e-05 -4.8e-06 ] [ -5.09e-05 -1.13e-05 1.7e-05 ] [ -5.5e-06 2.35e-05 9.6e-06 ] [ -2.34e-05 2.92e-05 -1.88e-05 ] [ 2.1e-06 5.2e-06 -1.68e-05 ] [ 4.21e-05 -1.15e-05 4.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.915961449856e-14 -3.813180357504e-14 1.538089555968e-14 ] [ 2.8038090864e-14 -1.794437815296e-14 -7.69044777984e-15 ] [ -8.155078999872e-14 -1.810459581504e-14 2.72370025536e-14 ] [ -8.8119714144e-15 3.76511505888e-14 1.538089555968e-14 ] [ -3.749093292672001e-14 4.678355732736e-14 -3.012092047104e-14 ] [ 3.36457090368e-15 8.33131842816e-15 -2.691656722944e-14 ] [ 6.745163573568001e-14 -1.84250311392e-14 6.568924145279999e-15 ] ] } "relaxed-potential-energy" { "source-value" -29.696934 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.757973336424062e-18 } }