Presentation on theme: "Crystallographic e-Lab-book Aims and Objectives:- Digital record of all data/information associated with a crystallographic experiment. Complete Lab Management."— Presentation transcript:
Crystallographic e-Lab-book Aims and Objectives:- Digital record of all data/information associated with a crystallographic experiment. Complete Lab Management System Consider SXRD and/or PXRD.
Crystallographic e-Lab-book 1.Internal (X-ray lab) Assigned data – local code, admin details…. Sample descriptors - colour, size, form…. Environmental data – temp, humidity/atmosphere…. Measured data – images – diffraction/sample…. Experimental report(s)…. Derived data – unit cell, hklF file…. Derived information – structure…. Computing records….
Crystallographic e-Lab-book 2. External – Prep lab Administrative data – originator, charge account etc. Chemistry data – sample origin, reference code, proposed formula, structure, analysis, compound properties, sample preparation….
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