Compound copper chalcogenide nanocrystals

C Coughlan, M Ibanez, O Dobrozhan, A Singh… - Chemical …, 2017 - ACS Publications
This review captures the synthesis, assembly, properties, and applications of copper
chalcogenide NCs, which have achieved significant research interest in the last decade due …

[PDF][PDF] Inverse design of high absorption thin-film photovoltaic materials

L Yu, RS Kokenyesi, DA Keszler… - Advanced Energy …, 2013 - ir.library.oregonstate.edu
Enhancement of photocarrier collection by aiding drift through a very thin inorganic absorber
film represents a promising route to new, high-efficiency photovoltaic (PV) devices.[1] The …

Electronic and Photocatalytic Properties of Ag3PC4VI (C = O, S, Se): A Systemic Hybrid DFT Study

Z Ma, Z Yi, J Sun, K Wu - The Journal of Physical Chemistry C, 2012 - ACS Publications
Recently developed photoelectrode Ag3PO4 exhibits extremely high quantum yield (up to
90% at 420 nm) of O2 generation from water oxidation, but it can only absorb part of visible …

Validation of density functional theory methods for predicting the optical properties of cu-based multinary chalcogenide semiconductors

Q Wang, H Ma, B Ni, Y Li, S Huang… - The Journal of …, 2022 - ACS Publications
Copper-based chalcogenide semiconductors are particularly attractive materials for
photovoltaic and nonlinear optical applications. Unfortunately, accurate theoretical …

Near-edge band structures and band gaps of Cu-based semiconductors predicted by the modified Becke-Johnson potential plus an on-site Coulomb U

Y Zhang, J Zhang, W Gao, TA Abtew, Y Wang… - The Journal of …, 2013 - pubs.aip.org
Diamond-like Cu-based multinary semiconductors are a rich family of materials that hold
promise in a wide range of applications. Unfortunately, accurate theoretical understanding of …

Cu-based novel transition-metals chalcogenides for advanced optoelectronic and thermoelectric devices: first-principles study

B Gul, MS Khan, M Rahaman, G Periyasami… - Physica …, 2024 - iopscience.iop.org
Copper-containing ternary transition-metals chalcogenide semiconductors are remarkable
due to their potential employment in optical and electronic devices. Here, density functional …

Enhanced thermoelectric performance of ternary compound Cu3PSe4 by defect engineering

YM Zhang, XC Shen, YC Yan, GW Wang, GY Wang… - Rare Metals, 2020 - Springer
The diamond-like compound Cu 3 PSe 4 with low lattice thermal conductivity is deemed to
be a promising thermoelectric material, which can directly convert waste heat into electricity …

Screening novel candidates for mid-IR nonlinear optical materials from I 3–V–VI 4 compounds

Z Ma, J Hu, R Sa, Q Li, Y Zhang, K Wu - Journal of Materials Chemistry …, 2017 - pubs.rsc.org
Although numerous superior nonlinear optical (NLO) crystals for the UV-vis to the near-
infrared (IR) region have been established, the development of an efficient NLO material …

Theoretical Optimization of an Earth-Abundant and Environmentally Friendly Photovoltaic Absorber Cu3PSe4 from First-Principles Study to Device Simulation

C Lin, Y Xue, C Persson, D Huang - ACS Applied Materials & …, 2024 - ACS Publications
To seek an earth-abundant and environmentally friendly absorber for thin-film solar cells,
Cu3PSe4 is investigated by first-principles calculations and device simulations. We …

Copper Selenophosphate, Cu3PSe4, Nanoparticle Synthesis: Octadecane Is the Key to a Simplified, Atom-Economical Reaction

NA Neisius, LT MacHale, ER Snyder, RG Finke… - Nano Letters, 2023 - ACS Publications
Nanoparticle syntheses are designed to produce the desired product in high yield but
traditionally neglect atom-economy. Here we report that the simple, but significant, change of …