Density functional theory, Crystallography, Molecule, Condensed matter physics and Chemical shift are his primary areas of study. He studies Density functional theory, namely CASTEP. He usually deals with CASTEP and limits it to topics linked to Computer program and Computational science.
His work on Crystal structure as part of his general Crystallography study is frequently connected to Mature Bone and Cortical bone, thereby bridging the divide between different branches of science. The study incorporates disciplines such as Work, Crystal and Engineering physics in addition to Condensed matter physics. Chris J. Pickard combines subjects such as Proton NMR, Spectroscopy, Nuclear magnetic resonance spectroscopy, Computational chemistry and Projector augmented wave method with his study of Chemical shift.
His primary areas of investigation include Density functional theory, Ab initio, Crystallography, Condensed matter physics and Phase. His Density functional theory research focuses on Chemical shift and how it relates to Solid-state nuclear magnetic resonance, Computational chemistry, Nuclear magnetic resonance spectroscopy and Molecule. His Ab initio research includes themes of Metastability and Lithium.
His Crystallography study deals with Spectroscopy intersecting with Spectral line. He has researched Condensed matter physics in several fields, including Crystal and Graphene. Chris J. Pickard has included themes like Chemical physics, Hydrogen, Phase transition and Diffraction in his Phase study.
His primary areas of study are Chemical physics, Hydrogen, Density functional theory, Phase and Superconductivity. His study in Chemical physics is interdisciplinary in nature, drawing from both Helium, Molecule, Crystal structure and Gas giant. His Hydrogen research incorporates elements of Crystallography, Atom and Ion.
Chris J. Pickard interconnects Orthorhombic crystal system, Phase transition, Raman spectroscopy, X-ray crystallography and Chemical shift in the investigation of issues within Density functional theory. His Chemical shift research is multidisciplinary, incorporating perspectives in Proton NMR, Computational chemistry, Dipole and Carbon-13 NMR. Superconductivity is a subfield of Condensed matter physics that Chris J. Pickard explores.
His primary scientific interests are in Chemical physics, Hydrogen, Helium, Superconductivity and Crystallography. The Chemical physics study combines topics in areas such as Phase diagram, Renormalization, Gas giant, Density functional theory and Quantum fluctuation. His Density functional theory research is multidisciplinary, relying on both Raman spectroscopy, X-ray crystallography, Diamond anvil cell, Powder diffraction and Phase stability.
His research integrates issues of Polymorphism, Crystal structure, Spectral line, Nuclear magnetic resonance spectroscopy and Kinetic isotope effect in his study of Hydrogen. He has researched Superconductivity in several fields, including Dissociation, Lanthanum, Hydrogen sulfide and Supercritical fluid. His Crystallography research is multidisciplinary, incorporating elements of Ab initio, Nanoclusters and Conventional superconductor.
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First-principles simulation: ideas, illustrations and the CASTEP code
M D Segall;Philip J D Lindan;M J Probert;C J Pickard.
Journal of Physics: Condensed Matter (2002)
First principles methods using CASTEP
Stewart J. Clark;Matthew D. Segall;Chris J. Pickard;Phil J. Hasnip.
Zeitschrift Fur Kristallographie (2005)
Electronic structure, properties, and phase stability of inorganic crystals: A pseudopotential plane‐wave study
V. Milman;B. Winkler;J. A. White;C. J. Pickard.
International Journal of Quantum Chemistry (2000)
All-electron magnetic response with pseudopotentials: NMR chemical shifts
Chris J. Pickard;Francesco Mauri.
Physical Review B (2001)
Population analysis of plane-wave electronic structure calculations of bulk materials
M. D. Segall;R. Shah;C. J. Pickard;M. C. Payne.
Physical Review B (1996)
Ab initio random structure searching
Chris J Pickard;R J Needs.
Journal of Physics: Condensed Matter (2011)
Calculation of NMR chemical shifts for extended systems using ultrasoft pseudopotentials
Jonathan R. Yates;Chris J. Pickard;Francesco Mauri.
Physical Review B (2007)
Structure of phase III of solid hydrogen
Chris J. Pickard;Richard J. Needs.
Nature Physics (2007)
High-pressure phases of silane.
Chris J. Pickard;R. J. Needs.
Physical Review Letters (2006)
Reproducibility in density functional theory calculations of solids
Kurt Lejaeghere;Gustav Bihlmayer;Torbjörn Björkman;Torbjörn Björkman;Peter Blaha.
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