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/dports/science/openmx/openmx3.8/work/
H A DH2-075.dat11 # Definition of Atomic Species
14 Species.Number 1
15 <Definition.of.Atomic.Species
17 Definition.of.Atomic.Species>
H A DCafcc_FS.dat11 # Definition of Atomic Species
14 Species.Number 1
15 <Definition.of.Atomic.Species
17 Definition.of.Atomic.Species>
H A DPt13.dat11 # Definition of Atomic Species
14 Species.Number 1
15 <Definition.of.Atomic.Species
17 Definition.of.Atomic.Species>
H A DSi8.dat11 # Definition of Atomic Species
14 Species.Number 1
15 <Definition.of.Atomic.Species
17 Definition.of.Atomic.Species>
/dports/science/openmx/openmx3.8/work/DFT-D3/
H A DMono-Ben.dat12 # Definition of Atomic Species
15 Species.Number 2
16 <Definition.of.Atomic.Species
19 Definition.of.Atomic.Species>
/dports/science/openmx/openmx3.8/work/geoopt_example/
H A DMethane_DIIS.dat11 # Definition of Atomic Species
14 Species.Number 2
15 <Definition.of.Atomic.Species
18 Definition.of.Atomic.Species>
H A DTiO2_RF.dat11 # Definition of Atomic Species
14 Species.Number 2
15 <Definition.of.Atomic.Species
18 Definition.of.Atomic.Species>
H A DC16_EF.dat11 # Definition of Atomic Species
14 Species.Number 1
15 <Definition.of.Atomic.Species
17 Definition.of.Atomic.Species>
H A DMethane_EF.dat11 # Definition of Atomic Species
14 Species.Number 2
15 <Definition.of.Atomic.Species
18 Definition.of.Atomic.Species>
H A DMethane_RF.dat11 # Definition of Atomic Species
14 Species.Number 2
15 <Definition.of.Atomic.Species
18 Definition.of.Atomic.Species>
H A DSi7C_RF.dat11 # Definition of Atomic Species
14 Species.Number 2
15 <Definition.of.Atomic.Species
18 Definition.of.Atomic.Species>
H A DTiO2_BFGS.dat11 # Definition of Atomic Species
14 Species.Number 2
15 <Definition.of.Atomic.Species
18 Definition.of.Atomic.Species>
H A Dd-H2O_RF.dat11 # Definition of Atomic Species
14 Species.Number 2
15 <Definition.of.Atomic.Species
18 Definition.of.Atomic.Species>
H A DSi7C_EF.dat11 # Definition of Atomic Species
14 Species.Number 2
15 <Definition.of.Atomic.Species
18 Definition.of.Atomic.Species>
H A DC16_DIIS.dat11 # Definition of Atomic Species
14 Species.Number 1
15 <Definition.of.Atomic.Species
17 Definition.of.Atomic.Species>
H A DC16_RF.dat11 # Definition of Atomic Species
14 Species.Number 1
15 <Definition.of.Atomic.Species
17 Definition.of.Atomic.Species>
H A DMethane_BFGS.dat11 # Definition of Atomic Species
14 Species.Number 2
15 <Definition.of.Atomic.Species
18 Definition.of.Atomic.Species>
/dports/science/openmx/openmx3.8/work/input_example/
H A DHMn.dat11 # Definition of Atomic Species
14 Species.Number 2
15 <Definition.of.Atomic.Species
18 Definition.of.Atomic.Species>
H A DMol_MnO.dat11 # Definition of Atomic Species
14 Species.Number 2
15 <Definition.of.Atomic.Species
18 Definition.of.Atomic.Species>
H A DBenzene.dat11 # Definition of Atomic Species
14 Species.Number 2
15 <Definition.of.Atomic.Species
18 Definition.of.Atomic.Species>
H A DGlycine.dat11 # Definition of Atomic Species
14 Species.Number 4
15 <Definition.of.Atomic.Species
20 Definition.of.Atomic.Species>
H A DH2O.dat17 # Definition of Atomic Species
20 Species.Number 2
21 <Definition.of.Atomic.Species
24 Definition.of.Atomic.Species>
/dports/science/openmx/openmx3.8/work/cellopt_example/
H A DTiO2-RFC5.dat11 # Definition of Atomic Species
14 Species.Number 2
15 <Definition.of.Atomic.Species
18 Definition.of.Atomic.Species>
/dports/science/openmx/openmx3.8/work/force_example/
H A DGaAs_LDA.dat11 # Definition of Atomic Species
14 Species.Number 2
15 <Definition.of.Atomic.Species
18 Definition.of.Atomic.Species>
H A DGaAs_NC_SO.dat11 # Definition of Atomic Species
14 Species.Number 2
15 <Definition.of.Atomic.Species
18 Definition.of.Atomic.Species>

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