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

Chemical science (Cambridge), 2014-01, Vol.5 (8), p.3204-3213

2014

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

Dalton transactions : an international journal of inorganic chemistry, 2011-11, Vol.40 (42), p.11258-11266

2011

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Recent developments in computational actinide chemistry

Chemical Society reviews, 2003-01, Vol.32 (1), p.9-16

Kaltsoyannis, Nikolas

2003

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The Oxidation State of Ce in the Sandwich Molecule Cerocene

Journal of the American Chemical Society, 1996-12, Vol.118 (51), p.13115-13116

1996

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Nature of the Transition Metal−Cycloheptatrienyl Bond. Computational Studies of the Electronic Structure of [M(η7-C7H7)(η5-C5H5)] (M = groups 4−6)

Organometallics, 2005-03, Vol.24 (6), p.1189-1197

2005

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Hole localization in [AlO4] defects in silica materials

The Journal of chemical physics, 2005-04, Vol.122 (14)

2005

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Surface grafting as a route to modifying the gas-sensitive resistor properties of semiconducting oxides : Studies of Ru-grafted SnO2

Physical chemistry chemical physics : PCCP, 2001, Vol.3 (1), p.132-145

2001

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Electronic Structure of [U2(μ2-N2)(η5-C5Me5)2(η8-C8H4(SiPri 3)2)2]

Organometallics, 2004-02, Vol.23 (4), p.832-835

2004

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Computational study of analogues of the uranyl ion containing the -N=U=N- unit: density functional theory calculations on UO2(2+), UON+, UN2, UO(NPH3)3+, U(NPH3)2(4+), [UCl4[NPR3]2] (R = H, Me), and [UOCl4[NP(C6H5)3]]

Inorganic chemistry, 2000-12, Vol.39 (26), p.6009-6017

Kaltsoyannis, N

2000

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The Three-Dimensional Structure of the Titanium-Centered Active Site during Steady-State Catalytic Epoxidation of Alkenes

The journal of physical chemistry. B, 2001-09, Vol.105 (38), p.9028-9030

2001

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Are metal alkoxides linear owing to electrostatic repulsion?

Chemical communications (Cambridge, England), 2002-10 (20), p.2458-2459

2002

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Back bonding without σ-bonding: a unique π-complex of dinitrogen with uranium

Journal of organometallic chemistry, 2001-10, Vol.635 (1), p.69-74

2001

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Evidence for actinide metal to ligand π backbonding. Density functional investigations of the electronic structure of [{(NH2)3(NH3)U}2(μ2-η2:η2-N2)]

Chemical communications (Cambridge, England), 1998-08 (16), p.1665-1666

1998

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The Bond-Forming Reactions of Atomic Dications with Neutral Molecules: Formation of ArNH+ and ArN+ from Collisions of Ar2+ with NH3

Journal of the American Chemical Society, 2004-03, Vol.126 (11), p.3658-3663

2004

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Theoretical study of the effects of spin-orbit coupling on the valence photoelectron spectrum of HfCl4

Chemical physics letters, 1997-08, Vol.274 (4), p.405-409

Kaltsoyannis, Nikolas

1997

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The bond-forming reaction between CF22+ and H2O/D2O: A computational and experimental study

The Journal of chemical physics, 2003-07, Vol.119 (3), p.1421-1425

2003

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Molecular structures of two metal tetrakis(tetrahydroborates), Zr(BH4)(4) and U(BH4)(4): equilibrium conformations and barriers to internal rotation of the triply bridging BH4 groups

Inorganic chemistry, 2002-12, Vol.41 (25), p.6646-6655

2002

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A XANES and EXAFS Investigation of the Speciation of Selenite following Bacterial Metabolization

Inorganic chemistry, 1995-03, Vol.34 (6), p.1617-1619

1995

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The structural and electrochemical properties of new bis-imido transition metal salen complexes

Dalton transactions : an international journal of inorganic chemistry, 2003-09 (18), p.3591

2003

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Computational studies of the geometric and electronic structures of BF3+, AlF3+, CF32+ and SiF32

Chemical physics letters, 1999-11, Vol.313 (3-4), p.679-684

1999

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Multinuclear NMR, Raman, EXAFS, and X-ray diffraction studies of uranyl carbonate complexes in near-neutral aqueous solution. X-ray structure of [C(NH2)3]6[(UO2)3(CO3)6].cntdot.6.5H2O

Inorganic chemistry, 1995-09, Vol.34 (19), p.4797-4807

1995

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Electronic structure of f1 actinide complexes. Part 3 of [1]. Quasi-relativistic density functional calculations of the optical transition energies of PaX2-∼6 (X=F, Cl, Br, I)

Journal of alloys and compounds, 1998, Vol.271-73, p.859-862

KALTSOYANNIS, N

1998

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The Three-Dimensional Structure of the Titanium-Centered Active Site during Steady-State Catalytic Epoxidation of Alkenes

The journal of physical chemistry. B, 2003-02, Vol.107 (8), p.1932-1932

2003

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Relativistic effects in inorganic and organometallic chemistry

Journal of the Chemical Society. Dalton transactions, 1997-01 (1), p.1-12

Kaltsoyannis, Nikolas

1997

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Tricarbonylrhenium(I) halide complexes of chiral non-racemic 2-(dioxolanyl)-6-(dioxanyl)pyridine ligands: synthesis, NMR and DFT calculations

Polyhedron, 2003-11, Vol.22 (25), p.3371-3378

2003

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

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

Recent developments in computational actinide chemistry

The Oxidation State of Ce in the Sandwich Molecule Cerocene

Nature of the Transition Metal−Cycloheptatrienyl Bond. Computational Studies of the Electronic Structure of [M(η7-C7H7)(η5-C5H5)] (M = groups 4−6)

Hole localization in [AlO4] defects in silica materials

Surface grafting as a route to modifying the gas-sensitive resistor properties of semiconducting oxides : Studies of Ru-grafted SnO2

Electronic Structure of [U2(μ2-N2)(η5-C5Me5)2(η8-C8H4(SiPri 3)2)2]

Computational study of analogues of the uranyl ion containing the -N=U=N- unit: density functional theory calculations on UO2(2+), UON+, UN2, UO(NPH3)3+, U(NPH3)2(4+), [UCl4[NPR3]2] (R = H, Me), and [UOCl4[NP(C6H5)3]]

The Three-Dimensional Structure of the Titanium-Centered Active Site during Steady-State Catalytic Epoxidation of Alkenes

Are metal alkoxides linear owing to electrostatic repulsion?

Back bonding without σ-bonding: a unique π-complex of dinitrogen with uranium

Evidence for actinide metal to ligand π backbonding. Density functional investigations of the electronic structure of [{(NH2)3(NH3)U}2(μ2-η2:η2-N2)]

The Bond-Forming Reactions of Atomic Dications with Neutral Molecules: Formation of ArNH+ and ArN+ from Collisions of Ar2+ with NH3

Theoretical study of the effects of spin-orbit coupling on the valence photoelectron spectrum of HfCl4

The bond-forming reaction between CF22+ and H2O/D2O: A computational and experimental study

Molecular structures of two metal tetrakis(tetrahydroborates), Zr(BH4)(4) and U(BH4)(4): equilibrium conformations and barriers to internal rotation of the triply bridging BH4 groups

A XANES and EXAFS Investigation of the Speciation of Selenite following Bacterial Metabolization

The structural and electrochemical properties of new bis-imido transition metal salen complexes

Computational studies of the geometric and electronic structures of BF3+, AlF3+, CF32+ and SiF32

Multinuclear NMR, Raman, EXAFS, and X-ray diffraction studies of uranyl carbonate complexes in near-neutral aqueous solution. X-ray structure of [C(NH2)3]6[(UO2)3(CO3)6].cntdot.6.5H2O

Electronic structure of f1 actinide complexes. Part 3 of [1]. Quasi-relativistic density functional calculations of the optical transition energies of PaX2-∼6 (X=F, Cl, Br, I)

The Three-Dimensional Structure of the Titanium-Centered Active Site during Steady-State Catalytic Epoxidation of Alkenes

Relativistic effects in inorganic and organometallic chemistry

Tricarbonylrhenium(I) halide complexes of chiral non-racemic 2-(dioxolanyl)-6-(dioxanyl)pyridine ligands: synthesis, NMR and DFT calculations

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