| The Computational 2D Materials Database: High-Throughput Modeling and Discovery of Atomically Thin Crystals S Haastrup, M Strange, M Pandey, T Deilmann, PS Schmidt, NF Hinsche, ... 2D Materials 5, 042002, 2018 | 880 | 2018 |
| Two-dimensional MXenes as catalysts for electrochemical hydrogen evolution: A computational screening study M Pandey, KS Thygesen The Journal of Physical Chemistry C 121 (25), 13593-13598, 2017 | 215 | 2017 |
| New light‐harvesting materials using accurate and efficient bandgap calculations IE Castelli, F Hüser, M Pandey, H Li, KS Thygesen, B Seger, A Jain, ... Advanced Energy Materials 5 (2), 1400915, 2015 | 169 | 2015 |
| Defect-tolerant monolayer transition metal dichalcogenides M Pandey, FA Rasmussen, K Kuhar, T Olsen, KW Jacobsen, ... Nano letters 16 (4), 2234-2239, 2016 | 132 | 2016 |
| Band gap tuning and defect tolerance of atomically thin two-dimensional organic–inorganic halide perovskites M Pandey, KW Jacobsen, KS Thygesen The journal of physical chemistry letters 7 (21), 4346-4352, 2016 | 122 | 2016 |
| Sulfide perovskites for solar energy conversion applications: computational screening and synthesis of the selected compound LaYS 3 K Kuhar, A Crovetto, M Pandey, KS Thygesen, B Seger, PCK Vesborg, ... Energy & Environmental Science 10 (12), 2579-2593, 2017 | 119 | 2017 |
| Fundamental limitation of electrocatalytic methane conversion to methanol L Arnarson, PS Schmidt, M Pandey, A Bagger, KS Thygesen, ... Physical Chemistry Chemical Physics 20 (16), 11152-11159, 2018 | 101 | 2018 |
| Two-dimensional metal dichalcogenides and oxides for hydrogen evolution: a computational screening approach M Pandey, A Vojvodic, KS Thygesen, KW Jacobsen The journal of physical chemistry letters 6 (9), 1577-1585, 2015 | 92 | 2015 |
| Efficient Charge Separation in 2D Janus van der Waals Structures with Build-in Electric Fields and Intrinsic pn Doping AC Riis-Jensen*, M Pandey*, KS Thygesen, (*equal contributions) The Journal of Physical Chemistry C 122 (43), 24520-24526, 2018 | 91 | 2018 |
| Band structure engineered layered metals for low-loss plasmonics MN Gjerding, M Pandey, KS Thygesen Nature communications 8 (1), 15133, 2017 | 89 | 2017 |
| High-throughput computational assessment of previously synthesized semiconductors for photovoltaic and photoelectrochemical devices K Kuhar, M Pandey, KS Thygesen, KW Jacobsen ACS Energy Letters 3 (2), 436-446, 2018 | 64 | 2018 |
| Definition of a scoring parameter to identify low-dimensional materials components PM Larsen, M Pandey, M Strange, KW Jacobsen Physical Review Materials 3, 034003, 2019 | 50 | 2019 |
| Shining light on sulfide perovskites: LaYS3 material properties and solar cells A Crovetto, R Nielsen, M Pandey, L Watts, JG Labram, M Geisler, ... Chemistry of Materials, 2019 | 47 | 2019 |
| Heats of formation of solids with error estimation: The mBEEF functional with and without fitted reference energies M Pandey, KW Jacobsen Physical Review B 91 (23), 235201, 2015 | 47 | 2015 |
| Phase Transition of MoS2 Bilayer Structures M Pandey, P Bothra, SK Pati The Journal of Physical Chemistry C 120 (7), 3776-3780, 2016 | 38 | 2016 |
| Promising quaternary chalcogenides as high-band-gap semiconductors for tandem photoelectrochemical water splitting devices: A computational screening approach M Pandey, KW Jacobsen Physical Review Materials 2, 105402, 2018 | 28 | 2018 |
| Increased Loading of Eu3+ Ions in Monazite LaVO4 Nanocrystals via Pressure-Driven Phase Transitions P Gangwar, M Pandey, S Sivakumar, RGS Pala, G Parthasarathy Crystal growth & design 13 (6), 2344-2349, 2013 | 25 | 2013 |
| II–IV–V 2 and III–III–V 2 Polytypes as Light Absorbers for Single Junction and Tandem Photovoltaic Devices M Pandey*, K Kuhar*, KW Jacobsen, (*equal contributions) The Journal of Physical Chemistry C 121 (33), 17780-17786, 2017 | 24 | 2017 |
| Atomically thin ordered alloys of transition metal dichalcogenides: stability and band structures M Pandey, KW Jacobsen, KS Thygesen The Journal of Physical Chemistry C 120 (40), 23024-23029, 2016 | 24 | 2016 |
| Size-selective electrocatalytic activity of (Pt) n/MoS 2 for oxygen reduction reaction P Bothra, M Pandey, SK Pati Catalysis Science & Technology 6 (16), 6389-6395, 2016 | 19 | 2016 |
Kristian Sommer ThygesenProfessor of Theoretical Physics, Technical University of Denmark在 fysik.dtu.dk 的电子邮件经过验证
