Crystal structure, electronic structure, and optical properties of Cu4ZnGe2S7 and Cu4CdGe2S7: Polar diamond-like semiconductors exhibiting second harmonic generation
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OpenAlex topics: Chalcogenide Semiconductor Thin Films · Crystal Structures and Properties · Quantum Dots Synthesis And Properties
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References (97)
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1. The prediction of semiconducting properties in inorganic compounds10.1016/0022-3697(58)90050-7 ↗
2. Goryunova · 1965 · 242
3. A systematic method of deriving new semiconducting compounds by structural analogy10.1016/0022-3697(64)90176-3 ↗
4. The adamantine family of compounds10.1016/0146-3535(80)90018-0 ↗
5. Parthé · 1964 · 176
6. Parthé · 1996 · 170
7. The principles determining the structure of complex ionic crystals10.1021/ja01379a006 ↗
8. Multinary metal chalcogenides with tetrahedral structures for second-order nonlinear optical, photocatalytic, and photovoltaic applications10.1016/j.ccr.2018.04.014 ↗
9. A review on structure-performance relationship toward the optimal design of infrared nonlinear optical materials with balanced performances10.1016/j.ccr.2018.09.002 ↗
10. Emerging chalcogenide thin films for solar energy harvesting devices10.1021/acs.chemrev.1c00301 ↗
11. West · 2014
12. W.H. Hull, W.L. Bragg, Structure of some crystals. Proceedings of the Royal Society of London, Series A: Mathematical and Physical Sciences (76,1906-) 1913, 33, 277.
13. Das Kα-dublett nebst einer neubestimmung der gitterkonstanten einiger krystalle
14. Zinkblende- und Wurtzitüberstrukturen bei ternären Chalkogeniden der Zusammensetzung 1246310.1007/BF00917173 ↗
15. A new method of X-ray crystal analysis10.1103/PhysRev.10.661 ↗
16. Ueber die kristallstruktur des alpha- und beta-CdS, sowie des Wurtzits
17. Preparation and characterization of Cu2ZnGeS4−ySey10.1021/cm00008a023 ↗
18. Determination of the structure of Cu2ZnGeS4 polymorphs by lattice imaging and convergent-beam electron diffraction10.1107/S0108768186098282 ↗
19. Synthèse et polymorphisme de la briartite
20. Crystal growth of quaternary 122464 chalcogenides by iodine vapor transport10.1016/0022-0248(67)90009-7 ↗
21. Tetrahedral quaternary chalcogenides of the type Cu2-II-IV-S4(Se4)10.1016/0025-5408(74)90135-4 ↗
22. Synthesis, structure, linear and nonlinear optical properties of noncentrosymmetric quaternary diamond-like semiconductors, Cu2ZnGeSe4 (CZGSe) and the novel Cu4ZnGe2Se7
23. Synthesis and photoelectric properties of Cu2ZnGeS4 and Cu2ZnGeSe4 single-crystalline nanowire arrays10.1021/la401531r ↗
24. Photocathode characteristics of a spray-deposited Cu2ZnGeS4 thin film for CO2 reduction in a CO2-saturated aqueous solution10.1021/acsaem.9b01418 ↗
25. Zinc-based materials for photoelectrochemical reduction of carbon dioxide10.1021/acs.energyfuels.2c01350 ↗
26. Cu2ZnGeS4 as a novel hole transport material for carbon-based perovskite solar cells with power conversion efficiency above 18%
27. The crystal structure of Cu2CdGeS4 and other quaternary normal tetrahedral structure compounds10.1107/S0567740869003670 ↗
28. Optical nonlinearity in Cu2CdSnS4 and alpha/beta-Cu2ZnSiS4: diamond-like semiconductors with high laser-damage thresholds10.1021/ic501310d ↗
29. Electrical and optical properties of Cu2CdGeS4 single crystals10.1023/A:1025596903080 ↗
30. Colloidal synthesis of wurtz-stannite Cu2CdGeS4 nanocrystals with high catalytic activity toward iodine redox couples in dye-sensitized solar cells10.1039/C6CC05163D ↗
31. Phase matching, strong frequency doubling, and outstanding laser-induced damage threshold in the biaxial, quaternary diamond-like semiconductor Li4CdSn2S710.1021/acs.chemmater.0c03268 ↗
32. Cu4MnGe2S7 and Cu2MnGeS4: two polar thiogermanates exhibiting second harmonic generation in the infrared and structures derived from hexagonal diamond10.1039/D1DT02535J ↗
33. Crystal structure, electronic structure, and optical properties of the novel Li4CdGe2S7, a wide-bandgap quaternary sulfide with a polar structure derived from lonsdaleite
34. Crystal structures of the Ag4HgGe2S7 and Ag4CdGe2S7 compounds10.1016/S0925-8388(02)00016-6 ↗
35. Quaternary diamond-like chalcogenidometalate networks as efficient anode material in lithium-ion batteries10.1002/adfm.201301025 ↗
36. The first quaternary diamond-like semiconductor with 10-membered LiS4 rings exhibiting excellent nonlinear optical performances10.1039/C6CC09565H ↗
37. Li4HgSn2Se7: the first second-order nonlinear optical-active selenide in the I4–II–IV2–VI7 diamond-like family10.1021/acs.cgd.9b01074 ↗
38. Crystal structure and magnetic properties of Cu4NiSi2S710.1016/0025-5408(80)90218-4 ↗
39. Bruker APEX II, SMART, SAINT, Bruker AXS Inc.: Madison, Wisconsin, USA, 2012.
40. Sheldrick · 1996
41. G. M. Sheldrick, XPREP, Bruker AXS Inc.: Madison, Wisconsin, USA, 2008.
42. Crystal structure refinement with SHELXL
43. ShelXle: a Qt graphical user interface for SHELXL10.1107/S0021889811043202 ↗
44. Absolute structure and absolute configuration10.1107/S0108767399004262 ↗
45. Palmer · 2019
46. The highscore suite10.1017/S0885715614000840 ↗
47. The powder diffraction file: past, present, and future10.6028/jres.101.027 ↗
48. The powder diffraction file: present and future10.1107/S0108768102003312 ↗
49. Ein beitrag zur optik von farbanstrichen
50. Kortüm · 1969
51. From ultrasoft pseudopotentials to the projector augmented-wave method10.1103/PhysRevB.59.1758 ↗
52. Projector augmented-wave method10.1103/PhysRevB.50.17953 ↗
53. Generalized gradient approximation made simple10.1103/PhysRevLett.77.3865 ↗
54. Ab initio molecular dynamics for liquid metals10.1103/PhysRevB.47.558 ↗
55. Ab initio molecular-dynamics simulation of the liquid-metal--amorphous-semiconductor transition in germanium10.1103/PhysRevB.49.14251 ↗
56. Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set10.1016/0927-0256(96)00008-0 ↗
57. Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set10.1103/PhysRevB.54.11169 ↗
58. Band structure diagram paths based on crystallography10.1016/j.commatsci.2016.10.015 ↗
59. Special points for Brillouin-zone integrations10.1103/PhysRevB.13.5188 ↗
60. Hybrid functionals based on a screened Coulomb potential10.1063/1.1564060 ↗
61. Influence of the exchange screening parameter on the performance of screened hybrid functionals10.1063/1.2404663 ↗
62. A powder technique for the evaluation of nonlinear optical materials10.1063/1.1656857 ↗
63. Outstanding laser damage threshold in Li2MnGeS4 and tunable optical nonlinearity in diamond-like semiconductors10.1021/ic502981r ↗
64. Li2CdGeSe4 and Li2CdSnSe4: Biaxial nonlinear optical materials with strong infrared second-order responses and laser-induced damage thresholds influenced by photoluminescence10.1039/C7QI00004A ↗
65. The Kurtz-Perry powder technique revisited: a case study on the importance of reference quality and broadband nonlinear optical measurements using LiInSe2
66. Syntheses and crystal structures of the quaternary thio-germanates Cu4FeGe2S7 and Cu4CoGe2S7
67. α-Li2ZnGeS4: a wide-bandgap diamond-like semiconductor with excellent balance between laser-induced damage threshold and second harmonic generation response10.1021/acs.chemmater.0c02929 ↗
68. Li2ZnGeS4: a promising diamond-like infrared nonlinear optical material with high laser damage threshold and outstanding second-harmonic generation response10.1039/C9DT00269C ↗
69. Synthesis, physicochemical characterization and crystallographic twinning of Li2ZnSnS410.1016/j.jssc.2008.08.026 ↗
70. Revised effective ionic radii and systematic studies of interatomic distances in halides and chalcogenides10.1107/S0567739476001551 ↗
71. Li4MgGe2S7: the first alkali and alkaline-earth diamond-like infrared nonlinear optical material with exceptional large band gap10.1002/anie.202107613 ↗
72. Ellipsoidal analysis of coordination polyhedra10.1038/ncomms14235 ↗
73. The limited predictive power of the Pauling rules10.1002/anie.202000829 ↗
74. Modelling the structures of La2NiO410.1524/zkri.1992.199.3-4.255 ↗
75. Brown · 2016 · 336
76. Bond-valence parameters obtained from a systematic analysis of the inorganic crystal structure database10.1107/S0108768185002063 ↗
77. I. D. Brown, Bond Valence Parameters - 2020. https://www.iucr.org/resources/data/datasets/bond-valence-parameters (accessed 02/09/2022).
78. Phase relations in the quasi-binary Cu2GeS3–ZnS and quasi-ternary Cu2S–Zn(Cd)S–GeS2 systems and crystal structure of Cu2ZnGeS410.1016/j.jallcom.2004.12.045 ↗
79. T. Bernert, A. Pfitzner, M.I.V. Cu2MnMIVS4 = Si, Ge, Sn) - analysis of crystal structures and tetrahedra volumes of normal tetrahedral compounds Z. Krist. 220 2005 968 972 doi: 10.1524/zkri.2005.220.11_2005.968.10.1524/zkri.2005.220.11_2005.968 ↗
80. An X-ray study on the system Cu-S10.3891/acta.chem.scand.12-1415 ↗
81. Investigation of some ternary sulphides, selenides and tellurides of copper with elements of IVb groupe
82. Structural, thermodynamical and optical properties of Cu2-II-IV-VI4 quaternary compounds10.1007/s10853-005-1223-5 ↗
83. Preparation and properties of Cu2CdGeS4 crystals
84. Effects of magnetic transitions on the optical energy gap values of some I2.Mn.IV.VI4 phases
85. Optical and electrical properties of quaternary chalcogenides10.1016/0025-5408(77)90150-7 ↗
86. Density functional theory and the band gap problem10.1002/qua.560280846 ↗
87. Electronic structure and stability of quaternary chalcogenide semiconductors derived from cation cross-substitution of II-VI and I-III-VI2 compounds10.1103/PhysRevB.79.165211 ↗
88. Nikogosyan · 2005 · 427
89. Silver thiogallate and related diamond-like semiconductors for nonlinear-optical laser devices10.7567/JJAPS.32S3.653 ↗
90. Linear and nonlinear optical properties of LiInSe210.1063/1.1662654 ↗
91. W. Chen, J. Cousin, M.W. Sigrist, X. Gao, J.-J. Zondy, L. Isaenko, A. Yelisseyev, S. Lobanov, LiInS2 and LiInSe2: New nonlinear crystals for continuous-wave difference-frequency generation in the midinfrared 19th Annu. Meet. IEEE, Soc., L. a. E. -O., Ed. Montr., Can. 2006 88 89 doi: 10.1109/LEOS.2006.278850.10.1109/LEOS.2006.278850 ↗
92. Impact of Bandgap on Infrared Optical Nonlinearity in Novel Quaternary Chalcogenides: Cu2CdSnS4, α/β-Cu2ZnSiS4 and Li2CdGeS4
93. Li2CdGeS4, a diamond-like semiconductor with strong second-order optical nonlinearity in the infrared and exceptional laser damage threshold10.1021/cm501029s ↗
94. Multifunctional copper‐based quaternary chalcogenide semiconductors toward state‐of‐the‐art energy applications10.1002/cnma.201800321 ↗
95. Optimizing kesterite solar cells from Cu2ZnSnS4 to Cu2CdGe(S,Se)410.1039/D0TA11603C ↗
96. Li2HgMS4 (M = Si, Ge, Sn): new quaternary diamond-like semiconductors for infrared laser frequency conversion10.3390/cryst7040107 ↗
97. Data-driven review of thermoelectric materials: performance and resource considerations10.1021/cm400893e ↗