Temperature dependence of the effective mass of the hybrid organic-inorganic perovskites CH3NH3PbI3
Bibliographic record
Abstract
The material of methylammonium lead iodide, CH3NH3PbI3 (MAPbI3), has shown significant promise in solar cell applications. A way to infer the microscopic scattering mechanism(s) in MAPbI3 is through the measured temperature dependence of carrier mobility. To this end, how does the carrier effective mass depend on temperature, m* = m*(T), is a useful information since the mobility is a function of m*. By atomistic first principles, we report the calculated m*(T) due to the thermal expansion of MAPbI3 materials, in the experimentally relevant range of 130 K to room temperature. The calculated results suggest m* = m*(T) to be linear in T. The increase of m* versus temperature is predominantly due to the expansion of the longitudinal atomic spacing that weakens the s/p hybridization between the I/Pb atoms.
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How this classification was reachedexpand
Full frame machine prediction
Teacher imitationNot calibrated prevalence, not ground truth. Human validation pending. The Gemma side is a direct model label for every work in the frame, read from the title-only record. The Codex side is a classifier learned from the 10,348 direct Codex labels and calibrated to design-weighted sample rates; fields without enough sample support carry no Codex call. Candidate is the union of the two sides; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels.
Distilled classifier scores by category (both heads)
| Category | Codex | Gemma |
|---|---|---|
| Metaresearch | 0.000 | 0.000 |
| Meta-epidemiology (narrow) | 0.000 | 0.000 |
| Meta-epidemiology (broad) | 0.000 | 0.000 |
| Bibliometrics | 0.000 | 0.000 |
| Science and technology studies | 0.000 | 0.000 |
| Scholarly communication | 0.000 | 0.000 |
| Open science | 0.000 | 0.000 |
| Research integrity | 0.000 | 0.000 |
| Insufficient payload (model declined to judge) | 0.002 | 0.000 |
Machine scores (provisional)
The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.
Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.
score_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from itClassification
machine, unvalidatedMachine predicted; a candidate call from one source (direct Gemma or distilled Codex), not a consensus.
How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".