Lizardite
Auzende A L, Pellenq R J M, Devouard B, Baronnet A, Grauby O
Physics and Chemistry of Minerals 33 (2006) 266-275
Atomistic calculations of structural and elastic properties
of serpentine minerals: the case of lizardite
Note: 1T polytype
Note: Hypothetical structure derived
using semi-empirical potentials
_database_code_amcsd 0009030
5.434 5.434 7.153 90 90 120 P1
atom       x       y       z occ
Mg5  .326618 .999948 .442053
Mg6  .990738 .335829 .442052
Mg7  .654847 .664057 .442052
Si17 .324068 .666612 .063936
Si18 .657401 .333278 .063936
O8   .324068 .666612 .287454  .5
O9   .657401 .333278 .287454  .5
O10  .489887 .999945 .987327  .5
O11  .990735 .499097 .987326  .5
O12  .491582 .500792 .987326  .5
O19  .324068 .666611 .270587  .5
O20  .657401 .333279 .270587  .5
O21  .490254 .999946 .000822  .5
O22  .990735 .499465 .000823  .5
O23  .491213 .500424 .000823  .5
Oh13 .658679 .999945 .601383  .5
Oh14 .990735 .667889 .601389  .5
Oh15 .322789 .332000 .601389  .5
Oh16 .990734 .999945 .261445  .5
Oh24 .658484 .999946 .592063  .5
Oh25 .990736 .667694 .592072  .5
Oh26 .322984 .332194 .592072  .5
Oh27 .990735 .999945 .268871  .5
H1   .658317 .999945 .725929
H2   .990734 .667527 .725942
H3   .323152 .332362 .725942
H4   .990734 .999945 .135283