Browse Data ESRA-DFT-0005 DFT Public
Bingning Wang
0000-0001-5168-6493
Chen Liao
A Unique Case of the “Goldilocks Rule” in Solid-State Electrolytes: Two Are Good, Four Are Too Many
2025_BingningWang_ChenLiao_ACS.Appl.Energy.Mater._5c02674 ← click to see all uploads from this cell
10.1021/acsaem.5c02674 ↗
2026-08-13 00:22:29
649495ce-ba49-46b7-b73e-b22062b65137
How to Cite
1 — Cite the dataset paper
↗ View paper
2 — Cite the ESRA platform
Galib, M. et al. (2026). ESRA: Energy Storage Research Assistant. Argonne National Laboratory. https://github.com/MusannaGalib/esra-platform
CC BY 4.0  ·  Data shared under Creative Commons Attribution 4.0

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/global/cfs/cdirs/m4845/gsharing/bingning-wang/a-unique-case-of-the-goldilocks-rule-in/2025-bingningwang-chenliao-acsapplenergy/2025_BingningWang_ChenLiao_ACS.Appl.Energy.Mater._5c02674/dft/ESRA-DFT-0005/
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Linked Uploads

Type Group Date Project Link
NMR Chen Liao 2026-08-13 00:22 A Unique Case of the “Goldilocks Rule” in Solid-State Electrolytes: Two Are Good, Four Are Too Many same cell
EIS Chen Liao 2026-08-13 00:22 A Unique Case of the “Goldilocks Rule” in Solid-State Electrolytes: Two Are Good, Four Are Too Many same cell
Cycling Chen Liao 2026-08-13 00:22 A Unique Case of the “Goldilocks Rule” in Solid-State Electrolytes: Two Are Good, Four Are Too Many same cell

Experiment Metadata

Software Gaussian 16
Visibility public
Xc Functional wB97XD
System Studied UB, UB-OH, U-H, PU-CMe monomers (conformers); dimer pairs (intermolecular interactions)
Pseudopotential 6-31g(d)
Publication Doi 10.1021/acsaem.5c02674
Institution Code ESRA