Car–Parrinello molecular dynamics or CPMD refers to either a method used in molecular dynamics (also known as the Car–Parrinello method) or the computational...

method (Distribution of system data for parallel computing) Car–Parrinello molecular dynamics Anton – A specialized, massively parallel supercomputer designed...

Michele Parrinello (born 7 September 1945) is an Italian physicist particularly known for his work in molecular dynamics (the computer simulation of physical...

electronegativity. Roberto Car and Michele Parrinello, Phys. Rev. Lett. 55, 2471 (1985) Description: Unified Approach for Molecular Dynamics and Density Functional...

input generation and output processing. Car–Parrinello molecular dynamics Computational chemistry Molecular dynamics Monte Carlo algorithm Energy minimization...

matter physics Car–Parrinello molecular dynamics Electron localization function International Academy of Quantum Molecular Science Molecular modelling Physical...

List, Ltd. Chemistry portal Physics portal Bioinformatics Car–Parrinello molecular dynamics Comparison of force field implementations Computational biology...

Linear programming Branch and cut Branch and bound Molecular dynamics, Car–Parrinello molecular dynamics Space mapping Time stepping methods for dynamical...

Parrinello (born 1983), Italian boxer Car–Parrinello molecular dynamics This page lists people with the surname Parrinello. If an internal link intending to refer...

method Car–Parrinello molecular dynamics Comparison of force-field implementations Comparison of nucleic acid simulation software List of molecular graphics...

libraries and pedagogical tools Timeline of computational physics Car–Parrinello molecular dynamics Thijssen, Jos (2007). Computational Physics. Cambridge University...

Born-Oppenheimer molecular dynamics in the microcanonical(NVE) or canonical ensemble (NVT) Car-Parrinello molecular dynamics Constrained molecular dynamics for thermodynamic...

Molecular design software Molecular modelling Quantum chemistry Thomas–Fermi model Time-dependent density functional theory Car–Parrinello molecular dynamics...

independently developed by V. Cerny 1985 – Car–Parrinello molecular dynamics developed by Roberto Car and Michele Parrinello 1985 – Splay trees discovered by Sleator...

2009 he shared the Dirac Medal with Michele Parrinello for their development of the ab initio molecular dynamics simulation method. The method combines the...

equations, obtained for a periodic solid, CP to carry out Car-Parrinello molecular dynamics, and PostProc, which allows data analysis and plotting. Noteworthy...

Michele Parrinello, one of the pioneers of the whole field of Computational science and co-developer of the widely used Car–Parrinello molecular dynamics method...

structure methods based on either the Born-Oppenheimer Approximation or Car-Parrinello approaches. The simplest models include only van der Waals type attractions...

with periodic boundary conditions Valence bond programs Car–Parrinello molecular dynamics Community code database from MolSSI † "Academic": academic...

the lowest of all the possible configurations. By means of Car-Parrinello molecular dynamics simulations this conjecture have been theoretically confirmed...

calculating energies in atomic and molecular systems. Density functional theory Car–Parrinello molecular dynamics Quantum chemistry computer programs...

of homogeneous catalysis and molecular dynamics of transition metal complexes Roberto Car (1947–), developer of Car–Parrinello method Emily A. Carter, known...

1021/ja01379a006. Martonak R., Laio A., Parrinello M. (2003). "Predicting crystal structures: The Parrinello-Rahman method revisited". Physical Review...

Vladimir Rokhlin and Leslie Greengard. Car–Parrinello molecular dynamics developed by Roberto Car and Michele Parrinello 1990 – In computational genomics and...

10.2445W. doi:10.1103/PhysRevD.10.2445. Car, R.; Parrinello, M (1985). "Unified Approach for Molecular Dynamics and Density-Functional Theory". Physical...

research fellow, working on crystalline glucose. She used the Car–Parrinello molecular dynamics method to study glucose. Molteni joined the University of...

Short for Car–Parrinello Molecular Dynamics, this core performs ab-initio quantum mechanical molecular dynamics. Unlike classical molecular dynamics calculations...

susceptibilities, absorption spectra, and perform molecular dynamics simulations with Ehrenfest and Car–Parrinello methods. The code is written predominantly...

Donald H. Weingarten 1996 Steven Gwon Sheng Louie 1995 Roberto Car and Michele Parrinello 1994 John M. Dawson 1993 Kenneth G. Wilson List of American Physical...

Cartan–Karlhede algorithm Carter constant Cartoon physics Car–Parrinello method Car–Parrinello molecular dynamics Cascading gauge theory Casimir effect Casimir machine...