-------------------------------------------------------------------------------- This is Test : ElasticConstantsFirstStrainGradientNumerical_fcc_Al__TE_531821030293_000 Results for KIM Model : EMT_Asap_Standard_Jacobsen_Stoltze_Norskov_AlAgAuCuNiPdPt__MO_118428466217_002 Crystal strucutre : fcc Species : Al Relaxing the crystal to its equilibrium lattice constant -------------------------------------------------------- Lattice spacing energy 8.40015 -0.00000 4.20007 -3.24160 2.80005 -1.32496 4.90008 -2.68604 3.50006 -2.98616 3.85007 -3.26189 3.50006 -2.98616 4.02507 -3.28383 4.20007 -3.24160 3.93757 -3.28120 4.11257 -3.27006 3.98132 -3.28466 3.93757 -3.28120 4.00319 -3.28478 4.02507 -3.28383 3.99226 -3.28486 3.98132 -3.28466 3.99773 -3.28485 3.98679 -3.28480 3.99499 -3.28486 3.99773 -3.28485 3.99362 -3.28486 3.99636 -3.28486 3.99431 -3.28486 3.99362 -3.28486 3.99465 -3.28486 3.99499 -3.28486 3.99448 -3.28486 3.99482 -3.28486 3.99456 -3.28486 3.99473 -3.28486 3.99461 -3.28486 3.99456 -3.28486 3.99463 -3.28486 3.99459 -3.28486 3.99462 -3.28486 3.99460 -3.28486 3.99461 -3.28486 3.99460 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 3.99461 -3.28486 Equilibrium lattice spacing : 3.9946084278