pith. sign in

A. Daniel Boese

Identifiers

No identifiers captured yet.

Papers (10)

  1. ZMP-SAPT: DFT-SAPT using ab initio Densities physics.chem-ph · 2019 · author #1
  2. Towards Hybrid Density Functional Calculations of Molecular Crystals via Fragment-Based Methods physics.chem-ph · 2018 · author #3
  3. Anharmonic force fields of perchloric acid, HClO$_4$, and perchloric anhydride, Cl$_2$O$_7$. An extreme case of inner polarization physics.chem-ph · 2005 · author #1
  4. Assessment of Various Density Functionals and Basis Sets for the Calculation of Molecular Anharmonic Force Fields physics.chem-ph · 2005 · author #1
  5. Anharmonic force fields and thermodynamic functions using density functional theory physics.chem-ph · 2004 · author #1
  6. Development of Novel Density Functionals for Thermochemical Kinetics physics.chem-ph · 2004 · author #1
  7. Vibrational Spectra of the Azabenzenes Revisited: Anharmonic Force Fields physics.chem-ph · 2003 · author #1
  8. W3 theory: robust computational thermochemistry in the kJ/mol accuracy range physics.chem-ph · 2003 · author #1
  9. From ab initio quantum chemistry to molecular dynamics: The delicate case of hydrogen bonding in ammonia physics.chem-ph · 2003 · author #1
  10. The Role of the Basis Set: Assessing Density Functional Theory physics.chem-ph · 2003 · author #1

Mentions

No mention provenance yet.

Frequent Coauthors