Ran Crystal-Likeness Score (synthesizability) from CIF

Ran Check whether a CIF is a valid crystal structure

Ran Estimate raw material cost per kg

Ran Relax a crystal structure

Created LaCeNiH (I4mm) 1

Ran Predict a crystal structure

Created LaCeNiH (I4mm)

Ran Predict a crystal structure

Ran Predict a crystal structure

Created Crystalite de novo structures

Ran De novo generation

Created https://lnkd.in/p/dtbeg9g6

Created candidate_001(1).cif 1

Created candidate_001(1).cif

Created candidate_001(1).cif 1 - phonon dispersion

Ran Calculate phonon dispersion and band structure

Ran Calculate phonon dispersion and band structure

Created candidate_001.cif 1 - phonon dispersion 1

Ran Calculate phonon dispersion and band structure

Created candidate_001.cif 1 - phonon dispersion

Created candidate_001.cif 1

Created candidate_001.cif

Ran Calculate phonon dispersion and band structure

Ran Check phonon stability

Created gen_1.cif 1

Created gen_1.cif 1 - phonon dispersion

Ran Calculate phonon dispersion and band structure

Created gen_14.cif

Created gen_14.cif - phonon dispersion

Ran Calculate phonon dispersion and band structure

Created gen_9.cif 1 - phonon dispersion

Created gen_9.cif 1

Ran Calculate phonon dispersion and band structure

Created gen_12.cif 1 - phonon dispersion

Ran Calculate phonon dispersion and band structure

Created gen_12.cif 1

Created gen_11.cif - phonon dispersion

Ran Calculate phonon dispersion and band structure

Ran Calculate phonon dispersion and band structure

Ran Calculate phonon dispersion and band structure