Generalized Gradient Approximation Made Simple

John P. Perdew, Kieron Burke, Matthias Ernzerhof

Physical Review Letters

Numerical AnalysisEngineeringMachine LearningVariational AnalysisSimple Gga +17

Efficient iterative schemes for<i>ab initio</i>total-energy calculations using a plane-wave basis set

Georg Kresse, J. Furthmüller

Physical review. B, Condensed matter

Numerical AnalysisEngineeringComputational ChemistryEnergy MinimizationEfficient Iterative Schemes +15

Projector augmented-wave method

Peter E. Blöchl

Physical review. B, Condensed matter

EngineeringOptic DesignAugmentation ProcedureComputational ChemistryChemistry +17

First principles methods using CASTEP

Stewart J. Clark, Matthew Segall, Chris J. Pickard, +4

Zeitschrift für Kristallographie - Crystalline Materials

EngineeringComputational ChemistryElectronic StructureCastep CodeMethodological Development +14

Electron-hole diffusion lengths &gt; 175 μm in solution-grown CH ₃ NH ₃ PbI ₃ single crystals

Qingfeng Dong, Yanjun Fang, Yuchuan Shao, +4

Science

Iodide management in formamidinium-lead-halide–based perovskite layers for efficient solar cells

Woon Seok Yang, Byung-Wook Park, Eui Hyuk Jung, +8

Science

EngineeringOrganic Solar CellHalide PerovskitesChemistryPerovskite Module +14

Low trap-state density and long carrier diffusion in organolead trihalide perovskite single crystals

Dong Shi, Valerio Adinolfi, Riccardo Comin, +13

Science

Materials ScienceLow Trap-state DensityPolycrystalline Mapbx3 FilmsOrganolead Trihalide Mapbx3Physics +12

Perovskite light-emitting diodes with external quantum efficiency exceeding 20 per cent

Kebin Lin, Jun Xing, Li Na Quan, +14

Nature

PhotonicsElectrical EngineeringSolid-state LightingEngineeringPerovskite Solar Cell +7

Piezoresistance Effect in Germanium and Silicon

Charles S. Smith

Physical Review

Materials ScienceSemiconductorsEngineeringSpecific ResistancePhysics +11

High-quality bulk hybrid perovskite single crystals within minutes by inverse temperature crystallization

Makhsud I. Saidaminov, Ahmed L. Abdelhady, Banavoth Murali, +11

Nature Communications