受强制性开放获取政策约束的文章 - Piotr M. Kowalski了解详情
无法在其他位置公开访问的文章：18 篇
Benchmarking the DFT+U Method for Thermochemical Calculations of Uranium Molecular Compounds and Solids
G Beridze, PM Kowalski
The Journal of Physical Chemistry A 118 (50), 11797-11810, 2014
强制性开放获取政策： German Research Foundation
Ideal, defective, and gold-promoted rutile TiO(110) surfaces interacting with CO, H, and HO: Structures, energies, thermodynamics, and dynamics from PBE
M Farnesi Camellone, PM Kowalski, D Marx
Physical Review B—Condensed Matter and Materials Physics 84 (3), 035413, 2011
强制性开放获取政策： German Research Foundation
Formation of weakly bound, ordered adlayers of CO on rutile TiO2 (110): A combined experimental and theoretical study
M Kunat, F Traeger, D Silber, H Qiu, Y Wang, AC Van Veen, C Wöll, ...
The Journal of chemical physics 130 (14), 2009
强制性开放获取政策： German Research Foundation
Vibrational properties of silica species in MgO–SiO2 glasses obtained from ab initio molecular dynamics
G Spiekermann, M Steele-MacInnis, PM Kowalski, C Schmidt, S Jahn
Chemical Geology 346, 22-33, 2013
强制性开放获取政策： German Research Foundation
Probing structural homogeneity of La1-xGdxPO4 monazite-type solid solutions by combined spectroscopic and computational studies
N Huittinen, Y Arinicheva, PM Kowalski, VL Vinograd, S Neumeier, ...
Journal of Nuclear Materials 486, 148-157, 2017
强制性开放获取政策： Federal Ministry of Education and Research, Germany
High entropy fluorides as conversion cathodes with tailorable electrochemical performance
Y Cui, PA Sukkurji, K Wang, R Azmi, AM Nunn, H Hahn, B Breitung, ...
Journal of Energy Chemistry 72, 342-351, 2022
强制性开放获取政策： German Research Foundation, Helmholtz Association, European Commission
Energetics of defects formation and oxygen migration in pyrochlore compounds from first principles calculations
Y Li, PM Kowalski
Journal of nuclear materials 505, 255-261, 2018
强制性开放获取政策： Federal Ministry of Education and Research, Germany
Uptake of 226Ra in cementitious systems: a complementary solution chemistry and atomistic simulation study
S Lange, PM Kowalski, M Pšenička, M Klinkenberg, S Rohmen, ...
Applied Geochemistry 96, 204-216, 2018
强制性开放获取政策： European Commission
Vibrational mode frequencies of H4SiO4, D4SiO4, H6Si2O7, and H6Si3O9 in aqueous environment, obtained from ab initio molecular dynamics
G Spiekermann, M Steele-MacInnis, PM Kowalski, C Schmidt, S Jahn
The Journal of chemical physics 137 (16), 2012
强制性开放获取政策： German Research Foundation
Heat capacities of xenotime-type ceramics: An accurate ab initio prediction
Y Ji, G Beridze, D Bosbach, PM Kowalski
Journal of Nuclear Materials 494, 172-181, 2017
强制性开放获取政策： Federal Ministry of Education and Research, Germany
Highly Distorted Uranyl Ion Coordination and One/Two-Dimensional Structural Relationship in the Ba2[UO2(TO4)2] (T = P, As) System: An Experimental and …
S Wu, PM Kowalski, N Yu, T Malcherek, W Depmeier, D Bosbach, S Wang, ...
Inorganic chemistry 53 (14), 7650-7660, 2014
强制性开放获取政策： 国家自然科学基金委员会, German Research Foundation
Unexpected Crystallographic Phase Transformation in Nonstoichiometric SrUO4–x: Reversible Oxygen Defect Ordering and Symmetry Lowering with Increasing …
GL Murphy, CH Wang, G Beridze, Z Zhang, JA Kimpton, M Avdeev, ...
Inorganic chemistry 57 (10), 5948-5958, 2018
强制性开放获取政策： Australian Research Council
Controlling oxygen defect formation and its effect on reversible symmetry lowering and disorder-to-order phase transformations in nonstoichiometric ternary uranium oxides
GL Murphy, CH Wang, Z Zhang, PM Kowalski, G Beridze, M Avdeev, ...
Inorganic chemistry 58 (9), 6143-6154, 2019
强制性开放获取政策： Australian Research Council
Cation-Dependent Structural Evolution in A2Th(TVO4)2 (A = Li, Na, K, Rb, Cs; T = P and As) Series
N Yu, VV Klepov, H Schlenz, D Bosbach, PM Kowalski, Y Li, EV Alekseev
Crystal growth & design 17 (3), 1339-1346, 2017
强制性开放获取政策： Helmholtz Association
Giant Volume Change and Topological Gaps in Temperature‐ and Pressure‐Induced Phase Transitions: Experimental and Computational Study of ThMo2O8
B Xiao, P Kegler, TM Gesing, L Robben, A Blanca‐Romero, PM Kowalski, ...
Chemistry–A European Journal 22 (3), 946-958, 2016
强制性开放获取政策： German Research Foundation, Helmholtz Association
Elastic and thermal parameters of lanthanide-orthophosphate (LnPO4) ceramics from atomistic simulations
Y Ji, NA Marks, D Bosbach, PM Kowalski
Journal of the European Ceramic Society 39 (14), 4264-4274, 2019
强制性开放获取政策： Federal Ministry of Education and Research, Germany
An experimental calorimetric and a DFT+ U study of the thermodynamic properties of Cs4UO24WO5W2O8O2 and Cs4 [UO27WO53O3]
MI Lelet, ML Yakun'kova, PM Kowalski, EV Suleimanov, CA Geiger, ...
The Journal of Chemical Thermodynamics 139, 105873, 2019
强制性开放获取政策： Austrian Science Fund, German Research Foundation
Pressure induced reduction in SrUO4–A topotactic pathway to accessing extreme incompressibility
GL Murphy, Z Zhang, HE Maynard-Casely, J Stackhouse, PM Kowalski, ...
Acta Materialia 243, 118508, 2023
强制性开放获取政策： Australian Research Council
可在其他位置公开访问的文章：43 篇
Composition, structure, and stability of the rutile surface: Oxygen depletion, hydroxylation, hydrogen migration, and water adsorption
PM Kowalski, B Meyer, D Marx
Physical Review B—Condensed Matter and Materials Physics 79 (11), 115410, 2009
强制性开放获取政策： German Research Foundation
Charge Localization Dynamics Induced by Oxygen Vacancies on the Surface
PM Kowalski, MF Camellone, NN Nair, B Meyer, D Marx
Physical review letters 105 (14), 146405, 2010
强制性开放获取政策： German Research Foundation
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