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Showing below up to 50 results in range #751 to #800.

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  1. Partial DOS of CO on Ni 111 surface
  2. Partial charge densities and STM simulations
  3. Performance issues, try NCORE, KPAR, ALGO, LREAL
  4. Personal computer installation
  5. Phelel params.hdf5
  6. Phonons: Theory
  7. Phonons from density-functional-perturbation theory
  8. Phonons from finite differences
  9. Plot BSE fatbands
  10. Plotting exciton wavefunction
  11. Plotting the BSE fatband structure of Si
  12. Plugins
  13. Practical considerations for transition state finding calculations
  14. Practical guide to GW calculations
  15. Precompiler options
  16. Preconditioning
  17. Preparing a POTCAR
  18. Preparing a Super Cell
  19. Profiling
  20. Projector-augmented-wave formalism
  21. Pulay stress
  22. QMAXFOCKAE
  23. QPOINTS
  24. QSPIRAL
  25. QUAD EFG
  26. RANDOM SEED
  27. REPORT
  28. RMM-DIIS
  29. ROPT
  30. RPA/ACFDT: Correlation energy in the Random Phase Approximation
  31. RSMBJ
  32. RWIGS
  33. Relaxed geometry
  34. SAXIS
  35. SCALEE
  36. SCH calculations
  37. SCISSOR
  38. SCSRAD
  39. SHAKEMAXITER
  40. SHAKETOL
  41. SIGMA
  42. SMASS
  43. SMBJ
  44. SMEARINGS
  45. SPRING
  46. SPRING K
  47. SPRING R0
  48. SPRING V0
  49. STEP MAX
  50. STEP SIZE

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