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Frank Neese

Showing results (451-460 of 560) with videos related to

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Physical Chemistry Chemical Physics : PCCP|May 20, 2024
Code generation in ORCA: progress, efficiency and tight integrationMarvin H Lechner, Anastasios Papadopoulos, Kantharuban Sivalingam, et al.
Inorganic Chemistry|January 22, 2021
A Quantum Chemistry View on Two Archetypical Paramagnetic Pentacoordinate Nickel(II) Complexes Offers a Fresh Look on Their NMR SpectraEnrico Ravera, Lucia Gigli, Barbara Czarniecki, et al.
Science (New York, N.Y.)|November 19, 2011
X-ray emission spectroscopy evidences a central carbon in the nitrogenase iron-molybdenum cofactorKyle M Lancaster, Michael Roemelt, Patrick Ettenhuber, et al.
Journal of the American Chemical Society|March 12, 2010
Cryoreduction of the NO-adduct of taurine:alpha-ketoglutarate dioxygenase (TauD) yields an elusive {FeNO}(8) speciesShengfa Ye, John C Price, Eric W Barr, et al.
Journal of the American Chemical Society|November 16, 2023
Nature of S-States in the Oxygen-Evolving Complex Resolved by High-Energy Resolution Fluorescence Detected X-ray Absorption SpectroscopyMaria Chrysina, Maria Drosou, Rebeca G Castillo, et al.
Inorganic Chemistry|November 9, 2004
Nonoxovanadium(IV) and oxovanadium(V) complexes with mixed O, X, O-donor ligands (X = S, Se, P, or PO)Tapan K Paine, Thomas Weyhermüller, Leonardo D Slep, et al.
Journal of the American Chemical Society|December 11, 2003
Mixed-valent [FeIV(mu-O)(mu-carboxylato)2FeIII]3+ coreLeonardo D Slep, Ana Mijovilovich, Wolfram Meyer-Klaucke, et al.
Nature Chemistry|June 22, 2013
Magnetic blocking in a linear iron(I) complexJoseph M Zadrozny, Dianne J Xiao, Mihail Atanasov, et al.
The Journal of Chemical Physics|March 5, 2014
Communication: multireference equation of motion coupled cluster: a transform and diagonalize approach to electronic structureMarcel Nooijen, Ondřej Demel, Dipayan Datta, et al.
Inorganic Chemistry|May 14, 2010
Tetrahedral and square planar Ni[(SPR(2))(2)N](2) complexes, R = Ph & (i)Pr revisited: experimental and theoretical analysis of interconversion pathways, structural preferences, and spin delocalizationDimitrios Maganas, Alexios Grigoropoulos, Sarah S Staniland, et al.
Pageof 56

Showing results (451-460 of 560) with videos related to

Sort By:
Pageof 56
Physical Chemistry Chemical Physics : PCCP|May 20, 2024
Code generation in ORCA: progress, efficiency and tight integrationMarvin H Lechner, Anastasios Papadopoulos, Kantharuban Sivalingam, et al.
Inorganic Chemistry|January 22, 2021
A Quantum Chemistry View on Two Archetypical Paramagnetic Pentacoordinate Nickel(II) Complexes Offers a Fresh Look on Their NMR SpectraEnrico Ravera, Lucia Gigli, Barbara Czarniecki, et al.
Science (New York, N.Y.)|November 19, 2011
X-ray emission spectroscopy evidences a central carbon in the nitrogenase iron-molybdenum cofactorKyle M Lancaster, Michael Roemelt, Patrick Ettenhuber, et al.
Journal of the American Chemical Society|March 12, 2010
Cryoreduction of the NO-adduct of taurine:alpha-ketoglutarate dioxygenase (TauD) yields an elusive {FeNO}(8) speciesShengfa Ye, John C Price, Eric W Barr, et al.
Journal of the American Chemical Society|November 16, 2023
Nature of S-States in the Oxygen-Evolving Complex Resolved by High-Energy Resolution Fluorescence Detected X-ray Absorption SpectroscopyMaria Chrysina, Maria Drosou, Rebeca G Castillo, et al.
Inorganic Chemistry|November 9, 2004
Nonoxovanadium(IV) and oxovanadium(V) complexes with mixed O, X, O-donor ligands (X = S, Se, P, or PO)Tapan K Paine, Thomas Weyhermüller, Leonardo D Slep, et al.
Journal of the American Chemical Society|December 11, 2003
Mixed-valent [FeIV(mu-O)(mu-carboxylato)2FeIII]3+ coreLeonardo D Slep, Ana Mijovilovich, Wolfram Meyer-Klaucke, et al.
Nature Chemistry|June 22, 2013
Magnetic blocking in a linear iron(I) complexJoseph M Zadrozny, Dianne J Xiao, Mihail Atanasov, et al.
The Journal of Chemical Physics|March 5, 2014
Communication: multireference equation of motion coupled cluster: a transform and diagonalize approach to electronic structureMarcel Nooijen, Ondřej Demel, Dipayan Datta, et al.
Inorganic Chemistry|May 14, 2010
Tetrahedral and square planar Ni[(SPR(2))(2)N](2) complexes, R = Ph & (i)Pr revisited: experimental and theoretical analysis of interconversion pathways, structural preferences, and spin delocalizationDimitrios Maganas, Alexios Grigoropoulos, Sarah S Staniland, et al.
Pageof 56