1# two potential (Nested Monte Carlo) with volume moves
2
3&GLOBAL
4  PROJECT H2O_TMC
5  PROGRAM TMC
6  RUN_TYPE TMC
7  PRINT_LEVEL LOW
8  #TRACE
9  WALLTIME 00:01:30
10&END GLOBAL
11&MOTION
12  &TMC
13      GROUP_ENERGY_SIZE 1
14      GROUP_ENERGY_NR   1
15      GROUP_CC_SIZE     0
16      NUM_MC_ELEM       20
17      ENERGY_FILE_NAME  H2O_ice.inp
18      TEMPERATURE       270
19      &MOVE_TYPE      ATOM_TRANS
20          SIZE          0.1
21          PROB          1
22          INIT_ACC_PROB 0.2
23      &END
24      &MOVE_TYPE      ATOM_SWAP
25      &END
26      &NMC_MOVES
27        NMC_FILE_NAME H2O_ice_2.inp
28        NR_NMC_STEPS    2
29        PROB            3
30        &MOVE_TYPE      ATOM_TRANS
31          SIZE          0.1
32          PROB          1
33          INIT_ACC_PROB 0.2
34        &END
35        &MOVE_TYPE      VOL_MOVE
36          SIZE          0.1
37          PROB          4
38        &END
39      &END NMC_MOVES
40      PRESSURE 0.01
41      NUM_MV_ELEM_IN_CELL 1
42      RND_DETERMINISTIC 42
43      INFO_OUT_STEP_SIZE 100
44      RESTART_OUT 0
45      PRINT_TEST_OUTPUT
46  &END TMC
47&END MOTION
48