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Al001_bc1.esm1
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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Al001_bc1.out
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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Al001_bc2.esm1
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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Al001_bc2.out
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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Al001_bc2_efield.esm1
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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Al001_bc2_efield.out
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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Al001_bc3.esm1
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References for ESM and case 'bc3' updated
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2018-06-28 16:41:01 +02:00 |
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Al001_bc3.out
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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Al001_bc3_m002.esm1
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References for ESM and case 'bc3' updated
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2018-06-28 16:41:01 +02:00 |
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Al001_bc3_m002.out
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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Al001_bc3_p002.esm1
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References for ESM and case 'bc3' updated
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2018-06-28 16:41:01 +02:00 |
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Al001_bc3_p002.out
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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Al001_bc3_v00.esm1
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References for ESM and case 'bc3' updated
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2018-06-28 16:41:01 +02:00 |
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Al001_bc3_v00.out
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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Al001_bc3_vm05.esm1
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References for ESM and case 'bc3' updated
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2018-06-28 16:41:01 +02:00 |
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Al001_bc3_vm05.out
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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Al001_bc3_vp05.esm1
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References for ESM and case 'bc3' updated
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2018-06-28 16:41:01 +02:00 |
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Al001_bc3_vp05.out
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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Al001_pbc.esm1
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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Al001_pbc.out
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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H2O_bc1.esm1
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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H2O_bc1.out
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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H2O_pbc.esm1
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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H2O_pbc.out
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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graphene_bc1.esm1
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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graphene_bc1.out
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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graphene_bc1_vc-relax.esm1
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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graphene_bc1_vc-relax.out
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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graphene_bc2.esm1
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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graphene_bc2.out
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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graphene_bc3.esm1
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References for ESM and case 'bc3' updated
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2018-06-28 16:41:01 +02:00 |
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graphene_bc3.out
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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graphene_bc3_vc-relax_p002.esm1
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References for ESM and case 'bc3' updated
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2018-06-28 16:41:01 +02:00 |
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graphene_bc3_vc-relax_p002.out
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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graphene_pbc.out
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Default ESM algorithm set to line minimization (mdiis still under development)
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2017-08-21 15:02:15 +00:00 |
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