How can Databases assist with the Prediction of Chemical Compounds?

Perspective: Crystal structure prediction at high pressures

(2014) Yanchao Wang et al.   JOURNAL OF CHEMICAL PHYSICS

Zinc oxide: Connecting theory and experiment

(2013) Dejan Zagorac et al.   Processing and Application of Ceramics

Quantitative Structure–Property Relationship Modeling of Diverse Materials Properties

(2012) Tu Le et al.   CHEMICAL REVIEWS

Investigation of structural relations among the compounds in the ICSD using geometry based comparison techniques

(2012) M. Sultania et al.   STRUCTURAL CHEMISTRY

Mechanical properties of hybrid inorganic–organic framework materials: establishing fundamental structure–property relationships

(2011) Jin Chong Tan et al.   CHEMICAL SOCIETY REVIEWS

Structure–property relationships of iron arsenide superconductors

(2011) Dirk Johrendt   JOURNAL OF MATERIALS CHEMISTRY

Atomic-level structure and structure–property relationship in metallic glasses

(2010) Y.Q. Cheng et al.   PROGRESS IN MATERIALS SCIENCE

Prediction, determination and validation of phase diagrams via the global study of energy landscapes

(2009) J. C. Schön et al.   International Journal of Materials Research

Crystal structure prediction from first principles

(2008) Scott M. Woodley et al.   NATURE MATERIALS

A complete representation of structure–property relationships in crystals

(2008) A. van de Walle   NATURE MATERIALS