The name "perovskite solar cell" refers to the ABX3
crystal structure of the absorber materials, called
perovskite structure, where A and B are
cations and X is an
anion. A cations with radii between 1.60
Å and 2.50 Å have been found to form perovskite structures. The most commonly studied perovskite absorber is
methylammonium lead trihalide (CH3NH3PbX3, where X is a
halogen ion such as
iodide,
bromide, or
chloride), which has an optical
bandgap between ~1.55 and 2.3
eV, depending on halide content. Formamidinium lead trihalide (H2NCHNH2PbX3) has also shown promise, with bandgaps between 1.48 and 2.2 eV. The perovskite composition H₂NCHNH₂PbI₃ and its favorable bandgap were first reported in the seminal work of Stoumpos, Malliakas, and Kanatzidis on semiconducting tin and lead iodide perovskites, and compositional variants of this system now form the basis of the most efficient perovskite solar cells known today. Its minimum bandgap is closer to the optimal for a
single-junction cell than methylammonium lead trihalide, so it should be capable of higher efficiencies. In this all solid state architecture, CsSnI₃ replaced the liquid electrolyte and provided both efficient hole conduction and additional solar light absorption extending into the red and near infrared. This work established that a three dimensional halide perovskite could function as an active semiconducting component in a solid-state device at high efficiency, and it laid essential groundwork for the modern generation of halide perovskite solar cells. A common concern is the inclusion of lead as a component of perovskite materials; solar cells composed from
tin-based perovskite absorbers such as CH3NH3SnI3 have also been reported, though with lower power-conversion efficiencies.
Shockley–Queisser limit Solar cell efficiency is limited by the
Shockley–Queisser limit. This calculated limit sets the maximum theoretical efficiency of a solar cell using a
single junction with no other loss aside from
radiative recombination in the solar cell. Based on the AM1.5G global solar spectra, the maximum power conversion efficiency is correlated to a respective bandgap, forming a parabolic relationship. This limit is described by the equation :\eta = t_s \times u (x_g) \times v(f, x_g, x_c) \times m(vx_g/x_c) Where :x_g = V_g/V_s \ ; \ x_c = V_c/V_s and
u is the ultimate efficiency factor, and
v is the ratio of open circuit voltage
Vop to band-gap voltage
Vg, and
m is the
impedance matching factor, and
Vc is the thermal voltage, and
Vs is the voltage equivalent of the temperature of the Sun. The most efficient bandgap is found to be at 1.34 eV, with a maximum power conversion efficiency (PCE) of 33.7%. Reaching this ideal bandgap energy can be difficult, but utilizing tunable perovskite solar cells allows for the flexibility to match this value. Further experimenting with
multijunction solar cells allow for the Shockley-Queisser limit to be surpassed, expanding to allow photons of a broader wavelength range to be absorbed and converted, without increasing thermalisation loss. The actual band gap for
formamidinium (FA) lead trihalide can be tuned as low as 1.48 eV, which is closer to the ideal bandgap energy of 1.34 eV for maximum power-conversion efficiency single junction solar cells, predicted by the Shockley–Queisser Limit. The 1.3 eV bandgap energy has been successfully achieved with the hybrid cell, which has a tunable bandgap energy (Eg) from 1.24 – 1.41 eV.
Multi-junction solar cells Multi-junction solar cells are capable of a higher power conversion efficiency (PCE), increasing the threshold beyond the thermodynamic maximum set by the
Shockley-Queisser limit for single junction cells. By having multiple bandgaps in a single cell, it prevents the loss of photons above or below the band gap energy of a
single junction solar cell. In
tandem (double) junction solar cells, PCE of 31.1% has been recorded, increasing to 37.9% for triple junction and 38.8% for quadruple junction solar cells. However, the
metal organic chemical vapor deposition (mocvd) process needed to synthesize lattice-matched and crystalline solar cells with more than one junction is very expensive, making it a less than ideal candidate for widespread use. Perovskite semiconductors offer an option that has the potential to rival the efficiency of multi-junction solar cells but can be synthesized under more common conditions at a greatly reduced cost. Rivalling the double, triple, and quadruple junction solar cells mentioned above, are all-perovskite tandem cells with a max PCE of 31.9%, all-perovskite triple-junction cell reaching 33.1%, and the perovskite-Si triple-junction cell, reaching an efficiency of 35.3%. These multi-junction perovskite solar cells, in addition to being available for cost-effective synthesis, also maintain high PCE under varying weather extremes, making them utilizable worldwide. Perovskite–silicon tandem solar cells (PSTSCs) are an emerging class of multi-junction photovoltaic devices. These cells combine a conventional silicon sub-cell with an upper perovskite absorber layer to achieve broader spectral utilization. Silicon has a band gap of approximately 1.12 eV, while the perovskite band gap can be tuned between about 1.6 and 1.8 eV, enabling theoretical power-conversion efficiencies of up to 45.3% for perovskite–silicon tandems. PSTSCs are commonly categorized by the number of electrical terminals used to interconnect the sub-cells. Two-terminal (2T) designs place the perovskite and silicon cells in series, joined by an interconnection layer. This architecture is relatively low-cost but requires strict current matching between the sub-cells; any mismatch results in current losses, and it constrains the perovskite band-gap selection to the illumination and the silicon cell's characteristics . Ongoing advances in perovskite chemistry, device architecture, and encapsulation may enable PSTSCs to become a high-efficiency option for applications where maximizing power per unit area is critical.
Chiral ligands Utilizing organic
chiral ligands shows promise for increasing the maximum power conversion efficiency for halide perovskite solar cells, when utilized correctly.
Chirality can be produced in inorganic semiconductors by enantiomeric distortions near the surface of the lattice, electronic coupling between the substrate and a chiral ligand, assembly into a chiral secondary structure, or chiral surface defects. By attaching a chiral phenylethylamine ligand to an achiral lead bromide perovskite nanoplatelet, a chiral inorganic-organic perovskite is formed. Inspection of the inorganic-organic perovskite via
Circular Dichroism (CD) spectroscopy, reveals two regions. One represents the
charge transfer between the ligand and the nanoplatelet (300-350 nm), and the other represents the excitonic absorption maximum of the perovskite. Evidence of charge transfer in these systems shows promise for increasing power conversion efficiency in perovskite solar cells.
Inorganic perovskites The organic component such as
methylammonium or
formamidinium is on of the basis of the chemical instability. Encapsulation to prevent this decay is expensive. Fully inorganic perovskites could minimize this problem. Fully inorganic perovskites have PCE over 21%. These high performing fully inorganic perovskite cells are created using CsPbI3-xBrx, which has a band gap similar to that of high performing OIHPs (~1.7 eV), as well as excellent optoelectrical properties. Although chemically stable, CsPbI3-x faces significant issues with phase stability that prevent its broad industrial application. In high efficiency CsPbI3, for example, the photoactive black α-phase is prone to transform into the inactive yellow δ-phase, seriously inhibiting the performance, especially when exposed to moisture. The challenge of stabilizing the photoactive black α-phase of inorganic perovskite materials has been tackled in a variety of strategies, including octahedral anchoring and secondary
crystal growth.
2D hybrid organic-inorganic perovskites 2D perovskites are characterized by improved stability and excitonic confinement properties compared with 3D perovskites, while maintaining the charge transport properties of 3D perovskite materials. Furthermore, the 2D hybrid organic-inorganic perovskite (HOIP) structure also eases the steric restrictions on the "B" cations, as outlined by the
Goldschmidt's tolerance factor in 3D HOIPs, providing a much larger compositional space to engineer new materials with tailored properties. t=\frac{r_A+r_X}{\sqrt{2}(r_B+r_X)} As
t approaches a value of one, what is known as the “aristotype” ideal cubic perovskite structure can form, in which
BX6 octahedra are corner-sharing with
A-cations occupied voids between octahedra. As
t deviates from unity, the favored structures become edge- and corner-sharing octahedra. Characteristically, in HOIPs, the
A-site is occupied by a small organic cation, as opposed to an inorganic cation. Methylammonium is frequently used as the organic cation. Generally, HOIPs studied thus far contain a divalent metallic atom in the
B-site (typically Pb or Sn) and a halogen (such as Cl, Br, or I) in the
X-site. Through X-ray diffraction (XRD), it has been determined that methylammonium lead iodide, MAPbI3, materials structure in orthorhombic arrangement at low temperatures, then transform to tetragonal at 162 K, and finally cubic arrangements at 327 K. This is just one example how varied and intriguing the phase changes, and phase diagrams, of these materials can be. HOIPs can be described with the formula (A’)
m(A)
n-1B
nX3
n+1. A’ can be divalent, in which case
m = 1, or monovalent, where
m = 2. The value of
n relies on precursor composition and indicates whether the HOIP will be considered two- or three-dimensional. When
n = \infty, the perovskite is 3D, whereas when
n = 1, it is purely 2D. For perovskites where 1\leq n \leq 5, they are called quasi-2D. 2D halide perovskite layers can be conceptualized as truncated crystallographic planes from the corresponding 3D perovskite structure. By cutting along the \langle 100 \rangle, \langle 110\rangle, \langle111\rangle planes, three families of 2D perovskites can be described. The most commonly reported 2D HOIPs are derived from \langle100\rangle-oriented perovskites. These materials can be further divided into Ruddlesden-Popper (RP) phases, Dion-Jacobson (DJ) phases, and phases with cations alternating within the interlayer space (ACI). Among these types, RP-phases are studied the most thus far. RP-phase HOIPs contain a relatively weak can der Waals gap between a bilayer of monovalent cations and two adjacent lead halide sheets. There is typically an
A’ organic cation, generally an aryl ammonium or alkyl cation, and a small
A cation, such as methylammonium or Cs+. The inorganic layers are offset by one octahedral unit between planes and also have in-plane displacement. In contrast, DJ-phase HOIPs tend to be made of diamine compounds. These diamine compounds have two amino groups on each end, thus avoiding any gaps between layers and instead forming hydrogen bonds with the inorganic sheets, and are therefore more stable. Inorganic layers in th DJ phase are not offset and stack directly on top of each other. ACI-phase HOIPs have an A and A’ cation, like RP-phase HOIPs, and combine the characteristics of both the RP and DJ phases. The small
A cation is able to reside in the led halide sheets as well as stacking in the interlayer spaces with the
A’ cation. The only reported cation to form the ACI structure is currently guanidinium (Gua+). Compared with three-dimensional perovskites, layered perovskites typically exhibit larger exciton binding energies, more pronounced excitonic absorption and emission features, and wider band gaps, although these properties depend strongly on the number of inorganic layers, the identity of the organic spacer, and structural distortions within the inorganic framework. Charge transport is also highly anisotropic: carrier motion is generally more efficient within the inorganic layers than across the organic interlayers, so crystal orientation can strongly influence device performance. These features have made layered perovskites of interest for solar cells, light-emitting diodes and other optoelectronic devices, where enhanced environmental stability can offset some of the transport limitations associated with reduced dimensionality. Gao et al. showed single-crystal (C6H5CH2NH3)2PbCl4 had mid-range anisotropy in these directions because of corner sharing inherent to the crystal structure. Similarly, another nanoindentation study found that changing the A ion from organic CH3NH3+ to inorganic Cs+ has negligible effects on the Young's modulus, whereas the Pb–X strength has the dominating effect. Due to the increased mechanical stability of the inorganic layers, nanoindentation finds that 2D HOIP structures with thicker and more densely packed inorganic layers have increased Young's moduli and increased stability. This study found that 2D HOIPs are softer than 3D counterparts due to a shift from covalent/ionic bonding to van der waals bonding. Halides with weaker
electronegativity form weaker bonds with the "B" cation resulting in increased (in magnitude) negative poisson ratio. At this scale,
quantum confinement effects fundamentally alter the
electronic structure by discretizing
energy levels rather than maintaining the continuous band structure characteristic of bulk
perovskites. This quantum confinement enables precise
band gap tuning through size control. For instance, cesium lead iodide (CsPbI3) quantum dots exhibit bandgaps tunable from approximately 1.73 eV in bulk form to over 2.0 eV in strongly confined quantum dots, while maintaining the photoactive
cubic perovskite phase that is
thermodynamically unstable in bulk form at
room temperature. This phase stability, combined with the inherent
defect tolerance of perovskite materials, positions quantum dot architectures as a potential approach for addressing the critical durability limitations of bulk perovskite films. This precise bandgap control allows quantum dot absorbers to be optimized for specific applications, including the 1.34 eV ideal bandgap for single-junction solar cells predicted by the
Shockley-Queisser limit, as well as complementary bandgaps for multi-junction tandem configurations. CsPbI3 quantum dot films treated with
formamidinium iodide (FAI) demonstrate electron mobilities reaching 0.50 cm2 V−1 s−1 and diffusion lengths of approximately 239 nm. Time-resolved
photoluminescence studies reveal that properly passivated quantum dot films exhibit average carrier lifetimes exceeding 13 ns, with suppressed
non-radiative recombination rates attributed to reduced defect densities at both
grain boundaries and surfaces. Furthermore, the discrete energy level structure in quantum dots can facilitate
type-II band alignment (a configuration where electrons and holes are confined in different spatial regions) at heterointerfaces, creating favorable energy cascades for directional charge transfer while maintaining spatial separation of electrons and holes to minimize recombination losses. This phenomenon offers a pathway to exceed the Shockley-Queisser efficiency limit of approximately 33.7% for single-junction solar cells. Perovskite quantum dots have demonstrated efficient MEG relative to other quantum dot systems, with lower threshold energies compared to conventional lead
chalcogenide quantum dots. Formamidinium lead iodide (FAPbI3) nanocrystals exhibit MEG thresholds as low as 2.25 E.g. (where E.g. is the bandgap energy) and MEG slope efficiencies (the rate at which additional excitons are generated per unit energy above threshold) reaching 75%. Surface passivation by ligands simultaneously addresses multiple degradation pathways. Strongly bound
phosphine oxide or
carboxylic acid groups coordinate with undercoordinated lead atoms, eliminating surface
trap states that would otherwise facilitate non-radiative recombination and serve as nucleation sites for decomposition. This represents the highest efficiency among
colloidal quantum dot solar cells of any composition. Manufacturing cost models indicate that achieving commercial viability (below $5/m2) requires simultaneous advances in synthesis yield (exceeding 75%), solvent recycling infrastructure, and automated production systems. All-perovskite tandem cells employing wide-bandgap quantum dot top cells paired with narrow-bandgap bulk perovskite bottom cells represent another avenue under investigation. Rice University scientists discovered a novel phenomenon of light-induced lattice expansion in perovskite materials. Perovskite
quantum dot solar cell technology may extend cell durability, which remains a critical limitation. In order to overcome the instability issues with lead-based organic perovskite materials in ambient air and reduce the use of lead, perovskite derivatives, such as Cs2SnI6 double perovskite, have been investigated. == Processing ==