Ab initio phase diagram of PbSe crystals calculated with the random phase approximation

TY - JOUR

T1 - Ab initio phase diagram of PbSe crystals calculated with the random phase approximation

AU - Schaefer, Tobias

AU - Fan, Zhaochuan

AU - Grünwald, Michael

AU - Kresse, Georg

N1 - Publisher Copyright: © 2018 American Physical Society.

PY - 2018/10/3

Y1 - 2018/10/3

KW - AUGMENTED-WAVE METHOD

KW - HIGH-PRESSURE

KW - NANOCRYSTALS

KW - METASTABILITY

KW - TRANSITIONS

KW - PBTE

UR - https://arxiv.org/abs/1807.11415

UR - http://www.scopus.com/inward/record.url?scp=85054566597&partnerID=8YFLogxK

U2 - 10.1103/PhysRevB.98.144103

DO - 10.1103/PhysRevB.98.144103

M3 - Article

SN - 2469-9950

VL - 98

JO - Physical Review B

JF - Physical Review B

IS - 14

M1 - 144103

ER -