1# two potential (Nested Monte Carlo) on 3 temperatures and volume move and swaps
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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      NR_TEMPERATURE 3
19      TEMPERATURE 270 330
20      &NMC_MOVES
21        NMC_FILE_NAME H2O_ice_2.inp
22        NR_NMC_STEPS 2
23        &MOVE_TYPE      ATOM_TRANS
24          SIZE          0.1
25          PROB          1
26          INIT_ACC_PROB 0.2
27        &END
28        &MOVE_TYPE      VOL_MOVE
29          SIZE          0.01
30          PROB          8
31        &END
32      &END NMC_MOVES
33      &MOVE_TYPE      PT_SWAP
34        PROB          5
35      &END
36      PRESSURE 0.001
37      NUM_MV_ELEM_IN_CELL 1
38      RND_DETERMINISTIC 42
39      INFO_OUT_STEP_SIZE 10
40      RESTART_OUT 0
41      PRINT_TEST_OUTPUT
42  &END TMC
43&END MOTION
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