Cs–In system

12 accepted literature values from 1 paper(s) (experimental 4, DFT 8); 1 calculated phase diagram(s).

Data: JSON · CSV · interactive explorer · interactive phase diagram · phases (7) · papers (bibliography) · Markdown

Accepted values by evidence class
Evidence class	Values
experimental	4
DFT	8

Accepted values by property group
Property group	Values
crystal structure	12

Calculated phase diagrams

Binary phase diagrams calculated with pycalphad 0.11.2 from the SGTE binary collection (Hallstedt 2025, CC BY 4.0). Evidence class: model.

Assessments with a calculated phase diagram
TDB file	Assessment	SHA-256	Links
CsIn-10Lee.tdb	S.H. Lee, Z.-K. Liu, Calphad, 34, 134-37(2010). doi:10.1016/j.calphad.2010.01.005	`b36e9eae5cebe1d277ee88cadbd535ba3cbd9cc7564ae12ef26bc5d364aa9992`	viewer · TDB · JSON

Calculated three-phase invariants (model, mole fraction of the second component)
TDB file	T (K)	Phases at the invariant
CsIn-10Lee.tdb	837.17	LIQUID#2 (x(In) 0.1109) + CS2IN3 (x(In) 0.6) + LIQUID (x(In) 0.60889)
CsIn-10Lee.tdb	757.07	CS2IN3 (x(In) 0.6) + CSIN3 (x(In) 0.75) + LIQUID (x(In) 0.80554)
CsIn-10Lee.tdb	757.07	CS2IN3 (x(In) 0.6) + CSIN3 (x(In) 0.75) + LIQUID (x(In) 0.80579)
CsIn-10Lee.tdb	757.07	CS2IN3 (x(In) 0.6) + CSIN3 (x(In) 0.75) + LIQUID (x(In) 0.80527)
CsIn-10Lee.tdb	421.87	CSIN3 (x(In) 0.75) + LIQUID (x(In) 0.98791) + TETRAGONAL_A6 (x(In) 1)
CsIn-10Lee.tdb	421.87	CSIN3 (x(In) 0.75) + LIQUID (x(In) 0.98795) + TETRAGONAL_A6 (x(In) 1)
CsIn-10Lee.tdb	421.87	CSIN3 (x(In) 0.75) + LIQUID (x(In) 0.988) + TETRAGONAL_A6 (x(In) 1)
CsIn-10Lee.tdb	421.87	CSIN3 (x(In) 0.75) + LIQUID (x(In) 0.988) + TETRAGONAL_A6 (x(In) 1)
CsIn-10Lee.tdb	301.59	LIQUID (x(In) 0) + BCC_A2 (x(In) 1.000e-5) + CS2IN3 (x(In) 0.6)
CsIn-10Lee.tdb	301.59	LIQUID (x(In) 0) + BCC_A2 (x(In) 1.000e-5) + CS2IN3 (x(In) 0.6)

Convex hulls: Materials Project DFT hull · OQMD DFT hull

Other properties

Crystal structure (12)

Crystal structure, Cs–In system
Property	Value	T (K)	Phases / composition	Class	Source	Location
Lattice a	7.062 Å	0	Cs2In3 alloy: In 0.6	DFT	[1] Lee 2010	Table 1, p. 2, row 11 report
Lattice a	7.062 Å	0	Cs2In3 alloy: In 0.6	DFT	[1] Lee 2010	Table 1, p. 2, row 8 report
Lattice a	6.91 not_printed ± 0.003		Cs2In3 alloy: In 0.6	experimental	[1] Lee 2010 cites Yatsenko 1985 doi	Table 1, p. 2, row 9 report
Lattice a	7.197 Å	0	CsIn3 alloy: In 0.75	DFT	[1] Lee 2010	Table 1, p. 2, row 6 report
Lattice a	7.197 Å	0	CsIn3 alloy: In 0.75	DFT	[1] Lee 2010	Table 1, p. 2, row 10 report
Lattice a	7.047 not_printed ± 0.004		CsIn3 alloy: In 0.75	experimental	[1] Lee 2010 cites Tschuntonow 1984 doi	Table 1, p. 2, row 7 report
Lattice c	16.824 Å	0	Cs2In3 alloy: In 0.6	DFT	[1] Lee 2010	Table 1, p. 2, row 11 report
Lattice c	16.824 Å	0	Cs2In3 alloy: In 0.6	DFT	[1] Lee 2010	Table 1, p. 2, row 8 report
Lattice c	16.612 not_printed ± 0.007		Cs2In3 alloy: In 0.6	experimental	[1] Lee 2010 cites Yatsenko 1985 doi	Table 1, p. 2, row 9 report
Lattice c	17.109 Å	0	CsIn3 alloy: In 0.75	DFT	[1] Lee 2010	Table 1, p. 2, row 6 report
Lattice c	17.109 Å	0	CsIn3 alloy: In 0.75	DFT	[1] Lee 2010	Table 1, p. 2, row 10 report
Lattice c	16.803 not_printed ± 0.007		CsIn3 alloy: In 0.75	experimental	[1] Lee 2010 cites Tschuntonow 1984 doi	Table 1, p. 2, row 7 report

Sources

Reporting papers the values were read from (a value cited from another work names that work in its row).

Sung Hoon Lee, Zi-Kui Liu, First-principles calculations and thermodynamic modeling of Cs–In system, Calphad 34, 134-137 (2010). doi:10.1016/j.calphad.2010.01.005

Please cite

R. Arróyave, J. Saal, D. Shin, ORCHID-Values: thermodynamic and phase-equilibrium values read from the literature (version 2026.10; Version 1, machine-extracted), Zenodo (2026). doi:10.5281/zenodo.23735569
R. Arróyave, J. Saal, D. Shin, ORCHID-Diagrams: calculated binary phase diagrams (version 2026.10), Zenodo (2026). doi:10.5281/zenodo.23735859
R. Arróyave, J. Saal, D. Shin, ORCHID-Hulls: binary convex hulls (Materials Project, OQMD, assessed CALPHAD) (version 2026.10), Zenodo (2026). doi:10.5281/zenodo.23735891
R. Arróyave, J. Saal, D. Shin, ORCHID data: umbrella record of the ORCHID datasets (version 2026.10; Version 1, machine-extracted), Zenodo (2026). doi:10.5281/zenodo.23736065

Also cite the original source of every value you use (paper_citation / paper_doi, and cited_dois for values the paper cites from earlier work); B. Hallstedt, The SGTE collection of binary datasets, Calphad 89 (2025) 102833, https://doi.org/10.1016/j.calphad.2025.102833 (CC BY 4.0), and the original assessment named in each file; A. Jain et al., The Materials Project: A materials genome approach to accelerating materials innovation, APL Materials 1 (2013) 011002, https://doi.org/10.1063/1.4812323 (CC BY 4.0); J. E. Saal et al., JOM 65 (2013) 1501, https://doi.org/10.1007/s11837-013-0755-4 and S. Kirklin et al., npj Comput. Mater. 1 (2015) 15010, https://doi.org/10.1038/npjcompumats.2015.10 (CC BY 4.0). Version 1, machine-extracted: values were read by language-model readers constrained to quote their source and checked automatically, and the release was then audited on the printed pages by adversarial audits, an independent second review of fit-facing records and a preliminary human review of a frozen sample. Flags such as accepted and ESPEI-ready record screening results, not certification; known issues are listed in the release notes.

@misc{orchid_literature_2026,
  author    = {Arr{\'o}yave, Raymundo and Saal, James and Shin, Dongwon},
  title     = {{ORCHID-Values: thermodynamic and phase-equilibrium values read from the literature}},
  version   = {2026.10},
  publisher = {Zenodo},
  year      = {2026},
  doi       = {10.5281/zenodo.23735569},
  url       = {https://doi.org/10.5281/zenodo.23735569},
  note      = {Version 1, machine-extracted}
}

@misc{orchid_phase_diagrams_2026,
  author    = {Arr{\'o}yave, Raymundo and Saal, James and Shin, Dongwon},
  title     = {{ORCHID-Diagrams: calculated binary phase diagrams}},
  version   = {2026.10},
  publisher = {Zenodo},
  year      = {2026},
  doi       = {10.5281/zenodo.23735859},
  url       = {https://doi.org/10.5281/zenodo.23735859}
}

@misc{orchid_hulls_2026,
  author    = {Arr{\'o}yave, Raymundo and Saal, James and Shin, Dongwon},
  title     = {{ORCHID-Hulls: binary convex hulls (Materials Project, OQMD, assessed CALPHAD)}},
  version   = {2026.10},
  publisher = {Zenodo},
  year      = {2026},
  doi       = {10.5281/zenodo.23735891},
  url       = {https://doi.org/10.5281/zenodo.23735891}
}

@misc{orchid_data_2026,
  author    = {Arr{\'o}yave, Raymundo and Saal, James and Shin, Dongwon},
  title     = {{ORCHID data: umbrella record of the ORCHID datasets}},
  version   = {2026.10},
  publisher = {Zenodo},
  year      = {2026},
  doi       = {10.5281/zenodo.23736065},
  url       = {https://doi.org/10.5281/zenodo.23736065},
  note      = {Version 1, machine-extracted}
}