| „Effects of biaxial strain on the improper multiferroicity in h-LuFeO3 films,“ K Sinha, Y Zhang, X Jiang, X Wang, X Zhang, PJ Ryan, JW Kim, J Bowlan, ... Phys. Rev. B, 0 | 1 | |
| A molecular-scale picture of the electrical double layer at TiO2-electrolyte interfaces C Zhang, M Andrade, Z Goldsmith, A Raman, Y Li, P Piaggi, X Wu, ... Bulletin of the American Physical Society, 2024 | | 2024 |
| A systematic study of chloride ion solvation in water using van der Waals inclusive hybrid density functional theory A Bankura, B Santra, RA DiStasio Jr, CW Swartz, ML Klein, X Wu Molecular Physics 113 (17-18), 2842-2854, 2015 | 60 | 2015 |
| Ab initio liquid water from PBE0 hybrid functional simulations Z Li, X Wu, R Car APS March Meeting Abstracts 2010, J27. 002, 2010 | 1 | 2010 |
| Ab initio Studies of Ionization Potentials of Hydrated Hydroxide and Hydronium CW Swartz, X Wu Physical review letters 111 (8), 087801, 2013 | 31 | 2013 |
| Ab initio theory and modeling of water M Chen, HY Ko, R Remsing, M Calegari Andrade, B Santra, Z Sun, ... APS March Meeting Abstracts 2018, P57. 002, 2018 | | 2018 |
| Ab initio theory and modeling of water M Chen, HY Ko, RC Remsing, MF Calegari Andrade, B Santra, Z Sun, ... Proceedings of the National Academy of Sciences 114 (41), 10846-10851, 2017 | 383 | 2017 |
| Ab initio theory of X-ray emission spectral of liquid water C Swartz, S Biswajit, R DiStasio, X Wu APS March Meeting Abstracts 2014, Y15. 007, 2014 | | 2014 |
| Ab-inito liquid water with hybrid functionals and dispersion interactions Z Li, X Wu, R DiStasio Jr, R Car APS March Meeting Abstracts 2012, H35. 004, 2012 | | 2012 |
| Accessing the accuracy of density functional theory through structure and dynamics of the water–air interface T Ohto, M Dodia, J Xu, S Imoto, F Tang, F Zysk, TD Kühne, Y Shigeta, ... The journal of physical chemistry letters 10 (17), 4914-4919, 2019 | 56 | 2019 |
| Accurate first-principles structures and energies of diversely bonded systems from an efficient density functional J Sun, RC Remsing, Y Zhang, Z Sun, A Ruzsinszky, H Peng, Z Yang, ... Nature chemistry 8 (9), 831-836, 2016 | 910 | 2016 |
| Advanced capabilities for materials modelling with Quantum ESPRESSO P Giannozzi, O Andreussi, T Brumme, O Bunau, MB Nardelli, M Calandra, ... Journal of physics: Condensed matter 29 (46), 465901, 2017 | 7108 | 2017 |
| AFRL-AFOSR-VA-TR-2016-0372 X Wu | | |
| An Efficient Real-Space Implementation of the van der Waals Energy and Analytical Forces in Plane-Wave Ab Initio Molecular Dynamics R DiStasio, Z Li, U Aschauer, X Wu, R Car APS March Meeting Abstracts 2011, A31. 009, 2011 | | 2011 |
| Aqueous solvation of the chloride ion revisited with density functional theory: impact of correlation and exchange approximations M DelloStritto, J Xu, X Wu, ML Klein Physical Chemistry Chemical Physics 22 (19), 10666-10675, 2020 | 29 | 2020 |
| Attacking the Strong and Weak Scaling Limits in Linear Scaling Hybrid Density Functional Theory R Distasio, HY Ko, J Jia, B Santra, Z Sparrow, A Vazquez-Mayagoitia, ... APS March Meeting Abstracts 2019, A22. 009, 2019 | | 2019 |
| Bridging X-ray absorption spectra and nuclear quantum effects in the hydrogen bond network of liquid water Z Sun, L Zheng, M Chen, M Klein, X Wu, F Paesani ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 256, 2018 | | 2018 |
| Center for the Computational Design of Functional Layered Materials: A New Energy Frontier Research Center at Temple University X Xi, JP Perdew, M Iavarone, X Wu, A Ruzsinszky, J Sun Bulletin of the American Physical Society 59, 2014 | | 2014 |
| Cl-solution studied by ab initio molecular dynamics considering nuclear quantum effect on proton Z Sun, M Chen, X Wu APS March Meeting Abstracts 2017, K26. 012, 2017 | | 2017 |
| Cl-solution studied by\textit {ab initio} molecular dynamics considering nuclear quantum effect on proton Z Sun, M Chen, X Wu Bulletin of the American Physical Society 62, 2017 | | 2017 |
Roberto CarRalph W Dornte Professor in Chemistry, Princeton University Verified email at princeton.edu