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B.G. Searle
B.G. Searle
Daresbury Laboratory
Computational chemistry
Ab initio
Chemistry
First principle
Ground state
4
Papers
59
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Electronic Excitations in Copper Oxides: Time-Dependent Density Functional Theory Calculations with a Self-Consistent Hybrid Kernel
2020
Journal of Physical Chemistry C
Aleksandar Živković
Nora H. de Leeuw
B.G. Searle
Leonardo Bernasconi
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Citations (1)
Parallel implementation of the ab initio CRYSTAL program: electronic structure calculations for periodic systems
2011
Proceedings of The Royal Society A: Mathematical, Physical and Engineering Sciences
I. J. Bush
Stanko Tomić
B.G. Searle
Giuseppe Mallia
C.L. Bailey
B. Montanari
Leonardo Bernasconi
J. M. Carr
Nicholas M. Harrison
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Citations (35)
Orientation effects in soft X-ray magnetic circular dichroism
1997
Journal of Electron Spectroscopy and Related Phenomena
J. van Elp
B.G. Searle
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Citations (8)
An ab initio study of the magnetic coupling in bi-metallic CrIII cyanides
1997
Chemical Physics Letters
N. M. Harrison
B.G. Searle
E. A. Seddon
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Citations (15)
1