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aramoall アーキテクチャ用 votca-xtp-tutorials パッケージのファイル一覧

/usr/share/doc/votca-xtp-tutorials/changelog.Debian.gz
/usr/share/doc/votca-xtp-tutorials/copyright
/usr/share/votca/tutorials-xtp/LICENSE.rst
/usr/share/votca/tutorials-xtp/README.rst
/usr/share/votca/tutorials-xtp/clean_notebooks.sh
/usr/share/votca/tutorials-xtp/GROMACS/KMC_Methane/GROMACS_KMC.ipynb
/usr/share/votca/tutorials-xtp/GROMACS/KMC_Methane/change_energy.py
/usr/share/votca/tutorials-xtp/GROMACS/KMC_Methane/lifetimes.xml
/usr/share/votca/tutorials-xtp/GROMACS/KMC_Methane/xml_editor.py
/usr/share/votca/tutorials-xtp/GROMACS/Methane/QMMM_GROMACS.ipynb
/usr/share/votca/tutorials-xtp/GROMACS/Methane/qmmm.xml
/usr/share/votca/tutorials-xtp/GROMACS/Methane/qmmm_mm.xml
/usr/share/votca/tutorials-xtp/GROMACS/Methane/system.xml
/usr/share/votca/tutorials-xtp/GROMACS/Methane/xml_editor.py
/usr/share/votca/tutorials-xtp/GROMACS/Methane/MD_FILES/conf.gro
/usr/share/votca/tutorials-xtp/GROMACS/Methane/MD_FILES/topol.tpr
/usr/share/votca/tutorials-xtp/GROMACS/Methane/MP_FILES/Methane_e.mps
/usr/share/votca/tutorials-xtp/GROMACS/Methane/MP_FILES/Methane_h.mps
/usr/share/votca/tutorials-xtp/GROMACS/Methane/MP_FILES/Methane_n.mps
/usr/share/votca/tutorials-xtp/GROMACS/Methane/MP_FILES/Methane_n2s1.mps
/usr/share/votca/tutorials-xtp/GROMACS/Methane/MP_FILES/Methane_s1.mps
/usr/share/votca/tutorials-xtp/GROMACS/Methane/QC_FILES/methane.xyz
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/LAMMPS_KMC.ipynb
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/eqm.jobs
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/iqm.jobs
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/qmmm_mm_jobs.xml
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/run.sh
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/state.hdf5
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/system.xml
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/xml_editor.py
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MD_FILES/newfile.data
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MD_FILES/traj.dump
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MD_FILES/MD_Input/molecule_in_vacuum.data
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MD_FILES/MD_Input/molecule_in_vacuum.in
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MD_FILES/MD_Input/molecule_in_vacuum.in.init
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MD_FILES/MD_Input/molecule_in_vacuum.in.output
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MD_FILES/MD_Input/molecule_in_vacuum.in.run
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MD_FILES/MD_Input/molecule_in_vacuum.in.settings
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/thiophene_e.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/thiophene_h.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/thiophene_n.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/GS_chelpg/log2mps.xml
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/GS_chelpg/molpol.xml
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/GS_chelpg/polar.xml
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/GS_chelpg/system.gbw
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/GS_chelpg/system.inp
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/GS_chelpg/system.log
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/GS_chelpg/system.pc_chelpg
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/GS_chelpg/system.prop
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/GS_chelpg/system.vpot
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/GS_chelpg/system_property.txt
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/GS_chelpg/thiophene_n-pol.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/GS_chelpg/thiophene_n.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/electron_chelpg/log2mps.xml
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/electron_chelpg/molpol.xml
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/electron_chelpg/polar.xml
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/electron_chelpg/system.gbw
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/electron_chelpg/system.inp
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/electron_chelpg/system.log
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/electron_chelpg/system.pc_chelpg
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/electron_chelpg/system.prop
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/electron_chelpg/system.vpot
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/electron_chelpg/system_property.txt
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/electron_chelpg/thiophene_e-pol.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/electron_chelpg/thiophene_e.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_0_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_100_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_101_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_102_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_103_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_104_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_105_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_106_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_107_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_108_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_109_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_10_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_110_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_111_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_112_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_113_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_114_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_115_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_116_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_117_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_118_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_119_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_11_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_120_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_121_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_122_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_123_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_124_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_125_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_126_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_127_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_128_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_129_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_12_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_130_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_131_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_132_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_133_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_134_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_135_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_136_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_137_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_138_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_139_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_13_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_140_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_141_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_142_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_143_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_144_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_145_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_146_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_147_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_148_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_149_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_14_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_150_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_151_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_152_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_153_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_154_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_155_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_156_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_157_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_158_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_159_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_15_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_160_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_161_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_162_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_163_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_164_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_165_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_166_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_167_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_168_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_169_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_16_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_170_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_171_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_172_n2s1.mps
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/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_174_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_175_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_176_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_177_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_178_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_179_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_17_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_180_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_181_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_182_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_183_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_184_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_185_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_186_n2s1.mps
/usr/share/votca/tutorials-xtp/LAMMPS/KMC_Thiophene/MP_FILES/frame_10000/n2s1/thiophene_187_n2s1.mps
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