TY - JOUR T1 - Density functional modeling of the local structure of kaolinite subjected to thermal dehydroxylation JO - Journal of Physical Chemistry A PY - 2010/01/01 AU - White CE AU - Provis JL AU - Proffen T AU - Riley DP AU - Van Deventer JSJ ED - DO - DOI: 10.1021/jp911108d VL - 114 IS - 14 SP - 4988 EP - 4996 Y2 - 2024/09/20 ER -