Joost VandeVondele

Atomic and Molecular Physics, and Optics · 2002–2020

A researcher in the Science corpus: 10 papers; trusts 4 researchers and is trusted by 10 researchers here, as inferred from the citation graph.

Subfields

• Atomic and Molecular Physics, and Optics — 64 citations into it; #1,468 of 7,135 by trust here, #664 by citations
• Materials Chemistry — 44 citations into it; #7,137 of 11,513 by trust here, #4,323 by citations
• Spectroscopy — 11 citations into it; #1,079 of 1,674 by trust here, #1,529 by citations
• Molecular Biology — 9 citations into it; #11,109 of 17,773 by trust here, #14,833 by citations

Whom Joost VandeVondele trusts overall

Their strongest outbound trust, strongest first, inferred from their citations.

1. Matthias Krack
2. Juerg Hutter
3. Axel D. Becke
4. Berend Smit
5. Michele Parrinello
6. J. Perdew

Who trusts Joost VandeVondele overall

1. Juerg Hutter
2. Marcella Iannuzzi
3. T. Bartels-Rausch
4. F. Schiffmann
5. Hans Senn
6. Xiandong Liu
7. David R. Bowler
8. Michele Ceriotti
9. Mihail Bogojeski
10. Venera Khoromskaia

Papers from Joost VandeVondele's perspective

Ordered by how strongly the researchers Joost VandeVondele trusts endorse each paper. Same corpus, a different order for every researcher.

1. Understanding Molecular Simulation
2. Modern methods and algorithms of quantum chemistry
3. A and V
4. AND T
5. Quantum statistical mechanics : Green's function methods in equilibrium and nonequilibrium problems
6. Simon
7. A cellular computer to implement the kalman filter algorithm
8. Commentary: The Materials Project: A materials genome approach to accelerating materials innovation
9. Nudged elastic band method for finding minimum energy paths of transitions
10. Escaping free-energy minima

Their papers

• cp2k: atomistic simulations of condensed matter systems (2014) — 2,814 citations
• Gaussian basis sets for accurate calculations on molecular systems in gas and condensed phases. (2007) — 4,031 citations
• Materials Cloud, a platform for open computational science (2020) — 393 citations
• CP2K: An electronic structure and molecular dynamics software package - Quickstep: Efficient and accurate electronic structure calculations. (2020) — 3,532 citations
• Catalyst support effects on hydrogen spillover (2017) — 875 citations
• An efficient orbital transformation method for electronic structure calculations (2003) — 598 citations
• Robust Periodic Hartree-Fock Exchange for Large-Scale Simulations Using Gaussian Basis Sets. (2009) — 313 citations
• Quickstep: Fast and accurate density functional calculations using a mixed Gaussian and plane waves approach (2005) — 5,065 citations
• Liquid Water from First Principles: Investigation of Different Sampling Approaches (2004) — 280 citations
• A Hamiltonian electrostatic coupling scheme for hybrid Car-Parrinello molecular dynamics simulations (2002) — 524 citations