TY  - GEN 
AU  - Seijas-Bellido, Juan Antonio
AU  - Samanta, Bipasa
AU  - Valadez-Villalobos, Karen
AU  - Gallardo Bernal, Juan Jesús
AU  - Navas Pineda, Francisco Javier
AU  - Balestra, Salvador R. G.
AU  - Madero Castro, Rafael María
AU  - Vicent-Luna, José Manuel
AU  - Tao, Shuxia
AU  - Toroker, Maytal Caspary
AU  - Anta, Juan Antonio
A4  - Química Física
PY  - 2022
SN  - 1549-960X
UR  - http://hdl.handle.net/10498/27538
AB  - Many key features in photovoltaic perovskites occur in relatively long time scales and involve mixed compositions. This requires realistic but also numerically simple models. In this work we present a transferable dassical force field to describe the...
LA  - eng
PB  - AMER CHEMICAL SOC
TI  - Transferable Classical Force Field for Pure and Mixed Metal Halide Perovskites Parameterized from First-Principles
DO  - 10.1021/acs.jcim.1c01506
ER  -