DFT+U study of the structures and properties of the actinide dioxides
Pegg, James T., Aparicio-Anglès, Xavier, Storr, Mark, de Leeuw, Nora H.
Published in Journal of nuclear materials (01.08.2017)
Published in Journal of nuclear materials (01.08.2017)
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Journal Article
Structural dynamics of Schottky and Frenkel defects in ThO2: a density-functional theory study
Moxon, Samuel, Skelton, Jonathan, Tse, Joshua S, Flitcroft, Joseph, Togo, A, Cooke, David J, Lora da Silva, E, Harker, Robert M, Storr, Mark T, Parker, Stephen C, Molinari, Marco
Published in Journal of materials chemistry. A, Materials for energy and sustainability (01.01.2022)
Published in Journal of materials chemistry. A, Materials for energy and sustainability (01.01.2022)
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Journal Article
Noncollinear Relativistic DFT + U Calculations of Actinide Dioxide Surfaces
Pegg, James T, Shields, Ashley E, Storr, Mark T, Scanlon, David O, de Leeuw, Nora H
Published in Journal of physical chemistry. C (10.01.2019)
Published in Journal of physical chemistry. C (10.01.2019)
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Journal Article
Interaction of hydrogen with actinide dioxide (111) surfaces
Pegg, James T, Shields, Ashley E, Storr, Mark T, Scanlon, David O, de Leeuw, Nora H
Published in The Journal of chemical physics (07.04.2019)
Published in The Journal of chemical physics (07.04.2019)
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Journal Article
The critical role of hydrogen on the stability of oxy-hydroxyl defect clusters in uranium oxide
Flitcroft, Joseph M., Molinari, Marco, Brincat, Nicholas A., Williams, Nicholas R., Storr, Mark T., Allen, Geoffrey C., Parker, Stephen C.
Published in Journal of materials chemistry. A, Materials for energy and sustainability (2018)
Published in Journal of materials chemistry. A, Materials for energy and sustainability (2018)
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Journal Article
Structure and Properties of Cubic PuH2 and PuH3: A Density Functional Theory Study
Smith, Thomas, Moxon, Samuel, Cooke, David J., Gillie, Lisa J., Harker, Robert M., Storr, Mark T., da Silva, Estelina Lora, Molinari, Marco
Published in Crystals (Basel) (01.10.2022)
Published in Crystals (Basel) (01.10.2022)
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Journal Article
Magnetic structure of UO 2 and NpO 2 by first-principle methods
Pegg, James T, Shields, Ashley E, Storr, Mark T, Wills, Andrew S, Scanlon, David O, de Leeuw, Nora H
Published in Physical chemistry chemical physics : PCCP (02.01.2019)
Published in Physical chemistry chemical physics : PCCP (02.01.2019)
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Journal Article
Modelling of dissolved H in Ga stabilised δ-Pu
Scott, Chris, Kenny, Steven D., Storr, Mark T., Willetts, Andrew
Published in Journal of nuclear materials (01.11.2013)
Published in Journal of nuclear materials (01.11.2013)
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Journal Article
Structural dynamics of Schottky and Frenkel defects in CeO2: a density-functional theory study
Smith, Thomas, Moxon, Samuel, Tse, Joshua S, Skelton, Jonathan M, Cooke, David J, Gillie, Lisa J, da Silva, E Lora, Harker, Robert M, Storr, Mark T, Parker, Stephen C, Molinari, Marco
Published in JPhys Energy (01.04.2023)
Published in JPhys Energy (01.04.2023)
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Journal Article
Kinetic Inhibitor of Hydrate Crystallization
Storr, Mark T, Taylor, Paul C, Monfort, Jean-Pierre, Rodger, P. Mark
Published in Journal of the American Chemical Society (11.02.2004)
Published in Journal of the American Chemical Society (11.02.2004)
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Journal Article
Arrested Ear Development in Corn Caused by a Component of Certain Surfactants
Schmitz, Gary L, Fassler, Nicholas T, Fellows, Gary M, Shirley, Amber M, Chamblee, Rick W, Finch, Charles W, Storr, Mark A, Vassalotti, Paul M, Klingaman, Troy D, Thomas, Walter E, Rathmann, Duane P
Published in Agronomy journal (01.11.2011)
Published in Agronomy journal (01.11.2011)
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Journal Article
Noncollinear Relativistic DFT + U Calculations of Actinide Dioxide Surfaces
Pegg, James T., Shields, Ashley E., Storr, Mark T., Scanlon, David O., de Leeuw, Nora H.
Published in Journal of physical chemistry. C (06.12.2018)
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Published in Journal of physical chemistry. C (06.12.2018)
Journal Article