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Kaltsoyannis, N. [Other]; Kaltsoyannis, Nikolas [Editor] ; Royal Society of Chemistry Faraday Division, General Discussion on Quantum Inorganic Chemistry 2003 York

Quantum inorganic chemistry : [a General Discussion on Quantum Inorganic Chemistry, was held at the University of York, UK on 14th, 15th and 16th April 2003]

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London: Faraday Division, Royal Society of Chemistry, 2003

Published in: Faraday discussions ; 124
Kaltsoyannis, Nikolas [Other]

Principles and applications of density functional theory in inorganic chemistry

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Berlin; Heidelberg [u.a.]: Springer, 2004-

Published in: Structure and bonding ; .
Kaltsoyannis, Nikolas [Author]; Scott, Peter [Author]

The f elements

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Oxford [u.a.]: Oxford University Press, 1999

Published in: Oxford chemistry primers ; 7600
Kerridge, A.; Kaltsoyannis, N.

The coordination of Sr2+ by hydroxide: a density functional theoretical study

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Royal Society of Chemistry (RSC), 2011

Published in: Dalton Transactions
Pedrick, E. A.; Wu, G.; Kaltsoyannis, N.; Hayton, T. W.

Reductive silylation of a uranyl dibenzoylmethanate complex: an example of controlled uranyl oxo ligand cleavage

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Royal Society of Chemistry (RSC), 2014

Published in: Chem. Sci.
Cloke, F. Geoffrey N.; Green, Jennifer C.; Kaltsoyannis, Nikolas

Electronic Structure of [U2(μ2-N2)(η5-C5Me5)2(η8-C8H4(SiPri3)2)2]

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American Chemical Society (ACS), 2004

Published in: Organometallics
Field, Christian N.; Green, Jennifer C.; Kaltsoyannis, Nikolas; McGrady, G. Sean; Moody, Aidan N.; Siggel, Michele; De Simone, Monica

Investigation of the bonding in methyl titanium trichloride by variable-energy photoelectron spectroscopy and density functional calculations

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Royal Society of Chemistry (RSC), 1997

Published in: Journal of the Chemical Society, Dalton Transactions
Price, Amy N.; Berryman, Victoria; Ochiai, Tatsumi; Shephard, Jacob J.; Parsons, Simon; Kaltsoyannis, Nikolas; Arnold, Polly L.

Contrasting behaviour under pressure reveals the reasons for pyramidalization in tris(amido)uranium(III) and tris(arylthiolate) uranium(III) molecules

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Springer Science and Business Media LLC, 2022

Published in: Nature Communications
Berryman, Victoria E. J.; Shephard, Jacob J.; Ochiai, Tatsumi; Price, Amy N.; Arnold, Polly L.; Parsons, Simon; Kaltsoyannis, Nikolas

Quantum chemical topology and natural bond orbital analysis of M–O covalency in M(OC6H5)4 (M = Ti, Zr, Hf, Ce, Th, Pa, U, Np)

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Royal Society of Chemistry (RSC), 2020

Published in: Physical Chemistry Chemical Physics
Edelstein, N. M.; Allen, P. G.; Bucher, J. J.; Shuh, D. K.; Sofield, C. D.; Kaltsoyannis, N.; Maunder, G. H.; Russo, M. R.; Sella, A.

The Oxidation State of Ce in the Sandwich Molecule Cerocene

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American Chemical Society (ACS), 1996

Published in: Journal of the American Chemical Society
Shephard, Jacob J.; Berryman, Victoria E. J.; Ochiai, Tatsumi; Walter, Olaf; Price, Amy N.; Warren, Mark R.; Arnold, Polly L.; Kaltsoyannis, Nikolas; Parsons, Simon

Covalent bond shortening and distortion induced by pressurization of thorium, uranium, and neptunium tetrakis aryloxides

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Springer Science and Business Media LLC, 2022

Published in: Nature Communications
Berryman, Victoria E. J.; Whalley, Zoë J.; Shephard, Jacob J.; Ochiai, Tatsumi; Price, Amy N.; Arnold, Polly L.; Parsons, Simon; Kaltsoyannis, Nikolas

Computational analysis of M–O covalency in M(OC6H5)4 (M = Ti, Zr, Hf, Ce, Th, U)

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Royal Society of Chemistry (RSC), 2019

Published in: Dalton Transactions
Cloke, F. Geoffrey N.; Green, Jennifer C.; Hitchcock, Peter B.; Joseph, Stephen C. P.; Mountford, Philip; Kaltsoyannis, Nikolas; McCamley, Andrew

Molecular and electronic structures of bis[1,4-bis(trimethylsilyl)cyclooctatetraene] sandwich complexes of titanium and zirconium

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Royal Society of Chemistry (RSC), 1994

Published in: Journal of the Chemical Society, Dalton Transactions
Galley, Shane S.; Arico, Alexandra A.; Lee, Tsung-Han; Deng, Xiaoyu; Yao, Yong-Xin; Sperling, Joseph M.; Proust, Vanessa; Storbeck, Julia S.; Dobrosavljevic, Vladimir; Neu, Jennifer N.; Siegrist, Theo; Baumbach, Ryan E.; Albrecht-Schmitt, Thomas E.; Kaltsoyannis, Nikolas; Lanatà, Nicola

Uncovering the Origin of Divergence in the CsM(CrO4)2 (M = La, Pr, Nd, Sm, Eu; Am) Family through Examination of the Chemical Bonding in a Molecular Cluster and by Band Structure Analysis

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American Chemical Society (ACS), 2018

Published in: Journal of the American Chemical Society

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