Nicholas C. Handy
Computational Chemistry & Drug Discovery · 2000–2003
A researcher in the Science corpus: 6 papers; trusts 2 researchers and is trusted by 14 researchers here, as inferred from the citation graph.
Subfields
- Computational Chemistry & Drug Discovery — 8 citations into it
Whom Nicholas C. Handy trusts overall
Their strongest outbound trust, strongest first, inferred from their citations.
Who trusts Nicholas C. Handy overall
- Roberto Peverati
- Donald G. Truhlar
- A. Daniel Boese
- Yan Zhao
- Stefan Grimme
- Neil Qiang Su
- Jan M. L. Martin
- Narbe Mardirossian
- Gustavo E. Scuseria
- V. Staroverov
Papers from Nicholas C. Handy's perspective
Ordered by how strongly the researchers Nicholas C. Handy trusts endorse each paper. Same corpus, a different order for every researcher.
- and s
- Commentary: The Materials Project: A materials genome approach to accelerating materials innovation
- TURBOMOLE: Modular program suite for ab initio quantum-chemical and condensed-matter simulations (Journal of Chemical Physics)
- Atomic Data and Nuclear Data Tables
- Oxidation energies of transition metal oxides within the GGA+U framework
- Linear response approach to the calculation of the effective interaction parameters in the LDA + U method
- Self-consistent meta-generalized gradient approximation within the projector-augmented-wave method
- The formation of molecular clouds in spiral galaxies
- Γ and B
- Python Materials Genomics (pymatgen): A robust, open-source python library for materials analysis
Their papers
- Left-right correlation energy (2001) — 1,336 citations
- The role of the basis set: Assessing density functional theory (2003) — 177 citations
- A new parametrization of exchange–correlation generalized gradient approximation functionals (2001) — 621 citations
- Analytical calculation of nuclear magnetic resonance indirect spin–spin coupling constants at the generalized gradient approximation and hybrid levels of density-functional theory (2000) — 285 citations
- Assessment of exchange correlation functionals (2000) — 80 citations
- New generalized gradient approximation functionals (2000) — 297 citations