| Stereochemical effects in supramolecular self-assembly at surfaces: 1-D versus 2-D enantiomorphic ordering for PVBA and PEBA on Ag (111) JV Barth, J Weckesser, G Trimarchi, M Vladimirova, A De Vita, C Cai, ... Journal of the American Chemical Society 124 (27), 7991-8000, 2002 | 235 | 2002 |
| Cs2PbI2Cl2, All-Inorganic Two-Dimensional Ruddlesden–Popper Mixed Halide Perovskite with Optoelectronic Response J Li, Q Yu, Y He, CC Stoumpos, G Niu, GG Trimarchi, H Guo, G Dong, ... Journal of the American Chemical Society 140 (35), 11085-11090, 2018 | 183 | 2018 |
| Global space-group optimization problem: Finding the stablest crystal structure without constraints G Trimarchi, A Zunger Physical Review B 75 (10), 104113, 2007 | 181 | 2007 |
| Construction and solution of a Wannier-functions based Hamiltonian in the pseudopotential plane-wave framework for strongly correlated materials D Korotin, AV Kozhevnikov, SL Skornyakov, I Leonov, N Binggeli, ... The European Physical Journal B 65 (1), 91, 2008 | 123 | 2008 |
| Polymorphous band structure model of gapping in the antiferromagnetic and paramagnetic phases of the Mott insulators MnO, FeO, CoO, and NiO G Trimarchi, Z Wang, A Zunger Physical Review B 97 (3), 035107, 2018 | 118 | 2018 |
| Structural and electronic properties of LaMnO_ {3} under pressure: An ab initio LDA+ U study G Trimarchi, N Binggeli Physical Review B 71 (3), 035101, 2005 | 99 | 2005 |
| α-Particle Detection and Charge Transport Characteristics in the A3M2I9 Defect Perovskites (A = Cs, Rb; M = Bi, Sb) KM McCall, Z Liu, G Trimarchi, CC Stoumpos, W Lin, Y He, I Hadar, ... ACS Photonics, 5 (9), 3748, 2018 | 90 | 2018 |
| Air-Stable Direct Bandgap Perovskite Semiconductors: All-Inorganic Tin-Based Heteroleptic Halides AxSnClyIz (A = Cs, Rb) J Li, CC Stoumpos, GG Trimarchi, I Chung, L Mao, M Chen, ... Chemistry of Materials 30 (14), 4847-4856, 2018 | 70 | 2018 |
| Direct thermal neutron detection by the 2D semiconductor 6LiInP2Se6 DG Chica, Y He, KM McCall, DY Chung, RO Pak, G Trimarchi, Z Liu, ... Nature 577, 346–349, 2020 | 64 | 2020 |
| Predicting stable stoichiometries of compounds via evolutionary global space-group optimization G Trimarchi, AJ Freeman, A Zunger Physical Review B 80 (9), 092101, 2009 | 63 | 2009 |
| Using design principles to systematically plan the synthesis of hole-conducting transparent oxides: Cu3VO4 and Ag3VO4 as a case study G Trimarchi, H Peng, J Im, AJ Freeman, V Cloet, A Raw, ... Physical Review B 84 (16), 165116, 2011 | 58 | 2011 |
| Defect anti-perovskite compounds Hg3Q2I2 (Q=S, Se and Te) for Room Temperature Hard Radiation Detection He, Kontsevoi, Stoumpos, Trimarchi, Islam, Liu, Kostina, Das, Wessels, ... Journal of the American Chemical Society, 2017 | 51 | 2017 |
| LDA+ DMFT implemented with the pseudopotential plane-wave approach G Trimarchi, I Leonov, N Binggeli, D Korotin, VI Anisimov Journal of Physics: Condensed Matter 20 (13), 135227, 2008 | 50 | 2008 |
| Mesoscopic chiral reshaping of the Ag (110) surface induced by the organic molecule PVBA JI Pascual, JV Barth, G Ceballos, G Trimarchi, A De Vita, K Kern, HP Rust The Journal of chemical physics 120 (24), 11367-11370, 2004 | 48 | 2004 |
| Possible pitfalls in theoretical determination of ground-state crystal structures: The case of platinum nitride X Zhang, G Trimarchi, A Zunger Physical Review B 79 (9), 092102, 2009 | 43 | 2009 |
| CaFe4As3: A Metallic Iron Arsenide with Anisotropic Magnetic and Charge-Transport Properties I Todorov, DY Chung, CD Malliakas, Q Li, T Bakas, A Douvalis, ... Journal of the American Chemical Society 131 (15), 5405-5407, 2009 | 42 | 2009 |
| Finding the lowest-energy crystal structure starting from randomly selected lattice vectors and atomic positions: first-principles evolutionary study of the Au–Pd, Cd–Pt, Al–Sc … G Trimarchi, A Zunger Journal of Physics: Condensed Matter 20, 295212, 2008 | 39 | 2008 |
| Structural, Optical, and Transport Properties of alpha- and beta-Ag3VO4 V Cloet, A Raw, KR Poeppelmeier, et al. Chemistry of Materials 24 (17), 3346-3354, 2012 | 36 | 2012 |
| Strain-minimizing tetrahedral networks of semiconductor alloys JZ Liu, G Trimarchi, A Zunger Physical review letters 99 (14), 145501, 2007 | 31 | 2007 |
| Structurally unstable AIIIBiO3 perovskites are predicted to be topological insulators but their stable structural forms are trivial band insulators G Trimarchi, X Zhang, A Freeman, A Zunger Phys. Rev. B 90, 161111, 2014 | 24 | 2014 |
Alex ZungerUniversity of Colorado ,Boulder,Colorado.Renewable and Sustainable Energy InstituteVerified email at colorado.edu
